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opls_lt.fdefn
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DefineFeature @atom:80 [$([CH3D4][C])]
Family 0CT
EndFeature
DefineFeature @atom:81 [$([CH2D4]([C])[C])]
Family 1CT
EndFeature
DefineFeature @atom:82 [$([CH1D4]([C])([C])[C])]
Family 2CT
EndFeature
DefineFeature @atom:83 [CH4D4]
Family 3CT
EndFeature
DefineFeature @atom:84 [$([CH0D4]([C])([C])([C])[C])]
Family 4CT
EndFeature
DefineFeature @atom:85 [$([#1][CH4])]
Family 5HC
EndFeature
DefineFeature @atom:85 [$([#1][CD4;!$([C][CD2,O,N][#6]);!$([C][F,Cl,Br,I])])]
Family 6HC
EndFeature
DefineFeature @atom:86 [$([CH0D3]([#6])([#6])=[#6])]
Family 7CM
EndFeature
DefineFeature @atom:87 [$([CH1D3]([#6])=[#6])]
Family 8CM
EndFeature
DefineFeature @atom:88 [$([CH2D3]=[#6])]
Family 9CM
EndFeature
DefineFeature @atom:89 [$([#1][CD3])]
Family 10HC
EndFeature
DefineFeature @atom:90 [$([c]([c])[c])]
Family 11CA
EndFeature
DefineFeature @atom:460 [$([c](c)(c)-[c](c)c)]
Family 12C!
EndFeature
DefineFeature @atom:91 [$([#1][c]([c])[c])]
Family 13HA
EndFeature
DefineFeature @atom:92 [$([c](c)(c)(c))]
Family 14CA
EndFeature
DefineFeature @atom:93 [$([CH3][c])]
Family 15CT
EndFeature
DefineFeature @atom:94 [$([CH2D4][c])]
Family 16CT
EndFeature
DefineFeature @atom:95 [$([CH1](=C)-[CH1]=C)]
Family 17C=
EndFeature
DefineFeature @atom:800 [$([Cl][CD4])]
Family 18Cl
EndFeature
DefineFeature @atom:801 [$([CH2D4]([!Cl])[Cl])]
Family 19CT
EndFeature
DefineFeature @atom:802 [$([#1][#6D4][Cl])]
Family 20HC
EndFeature
DefineFeature @atom:803 [$([CH1D4]([!Cl])([!Cl])[Cl])]
Family 21CT
EndFeature
DefineFeature @atom:804 [$([CH0D4]([!Cl])([!Cl])([!Cl])[Cl])]
Family 22CT
EndFeature
DefineFeature @atom:805 [$([Br][CD4])]
Family 23Br
EndFeature
DefineFeature @atom:806 [$([CH2D4]([!Br])[Br])]
Family 24CT
EndFeature
DefineFeature @atom:807 [$([#1][#6D4][Br])]
Family 25HC
EndFeature
DefineFeature @atom:808 [$([CH1D4]([!Br])([!Br])[Br])]
Family 26CT
EndFeature
DefineFeature @atom:809 [$([CH0D4]([!Br])([!Br])([!Br])[Br])]
Family 27CT
EndFeature
DefineFeature @atom:838 [$([I][CD4])]
Family 28I
EndFeature
DefineFeature @atom:835 [$([CH2D4]([!I])[I])]
Family 29CT
EndFeature
DefineFeature @atom:839 [$([#1][#6D4][I])]
Family 30HC
EndFeature
DefineFeature @atom:836 [$([CH1D4]([!I])([!I])[I])]
Family 31CT
EndFeature
DefineFeature @atom:837 [$([CH0D4]([!I])([!I])([!I])[I])]
Family 32CT
EndFeature
DefineFeature @atom:96 [$([OH][#6])]
Family 33OH
EndFeature
DefineFeature @atom:97 [$([#1][O][#6])]
Family 34HO
EndFeature
DefineFeature @atom:98 [$([#1][CH3][OH])]
Family 35HC
EndFeature
DefineFeature @atom:99 [$([C;H2,H3][OH])]
Family 36CT
EndFeature
DefineFeature @atom:100 [$([CH1][OH])]
Family 37CT
EndFeature
DefineFeature @atom:101 [$([CH0][OH])]
Family 38CT
EndFeature
DefineFeature @atom:102 [$([CH2]([OH])[C](F)(F)(F))]
Family 39CT
EndFeature
DefineFeature @atom:103 [$([C](F)(F)(F)[CH2]([OH]))]
Family 40CT
EndFeature
DefineFeature @atom:104 [$([OH][CH2][C](F)(F)(F))]
Family 41OH
EndFeature
DefineFeature @atom:105 [$([#1][O][CH2][C](F)(F)(F))]
Family 42HO
EndFeature
DefineFeature @atom:106 [$([F][C](F)(F)[CH2][OH])]
Family 43F
EndFeature
DefineFeature @atom:107 [$([#1][CH2]([OH])[C](F)(F)(F))]
Family 44HC
EndFeature
DefineFeature @atom:108 [$([c]([OH]))]
Family 45CA
EndFeature
DefineFeature @atom:109 [$([OH][c])]
Family 46OH
EndFeature
DefineFeature @atom:110 [$([#1][O][c])]
Family 47HO
EndFeature
DefineFeature @atom:111 [$([OH][C][C][OH])]
Family 48OH
EndFeature
DefineFeature @atom:112 [$([#1][O][C][C][OH])]
Family 49HO
EndFeature
DefineFeature @atom:113 [$([OH][#6][#6]([OH])[#6][OH])]
Family 50OH
EndFeature
DefineFeature @atom:113 [$([OH][#6]([#6][OH])[#6][OH])]
Family 51OH
EndFeature
DefineFeature @atom:114 [$([#1][O][#6][#6]([OH])[#6][OH])]
Family 52HO
EndFeature
DefineFeature @atom:114 [$([#1][O][#6]([#6][OH])[#6][OH])]
Family 53HO
EndFeature
DefineFeature @atom:115 [$([CH2D4]([OH])[#6]([OH])[#6][OH])]
Family 54CT
EndFeature
DefineFeature @atom:115 [$([CH2D4]([OH])[#6][OH])]
Family 55CT
EndFeature
DefineFeature @atom:116 [$([CH1D4]([OH])[#6]([OH])[#6][OH])]
Family 56CT
EndFeature
DefineFeature @atom:116 [$([CH1D4]([OH])([#6][OH])[#6][OH])]
Family 57CT
EndFeature
DefineFeature @atom:116 [$([CH1D4]([OH])[#6][OH])]
Family 58CT
EndFeature
DefineFeature @atom:117 [$([CH0D4]([OH])[#6]([OH])[#6][OH])]
Family 59CT
EndFeature
DefineFeature @atom:117 [$([CH0D4]([OH])([#6][OH])[#6][OH])]
Family 60CT
EndFeature
DefineFeature @atom:117 [$([CH0D4]([OH])[#6][OH])]
Family 61CT
EndFeature
DefineFeature @atom:118 [$([#1][CD4]([OH])[#6]([OH])[#6][OH])]
Family 62CT
EndFeature
DefineFeature @atom:118 [$([#1][CD4]([OH])([#6][OH])[#6][OH])]
Family 63CT
EndFeature
DefineFeature @atom:118 [$([#1][CD4]([OH])[#6][OH])]
Family 64CT
EndFeature
DefineFeature @atom:119 [$([O]([c;r6])[c;r6])]
Family 65O
EndFeature
DefineFeature @atom:120 [$([CH0](=C)-[CH0]=C)]
Family 66C=
EndFeature
DefineFeature @atom:121 [$([#8](c)[CD4])]
Family 67OS
EndFeature
DefineFeature @atom:122 [$([O]([C][*;!$([#7,#8])])[C][*;!$([#7,#8])])]
Family 68OS
EndFeature
DefineFeature @atom:123 [$([CH3D4][O][#6][*;!$([#7,#8])])]
Family 69CT
EndFeature
DefineFeature @atom:124 [$([CH2D4]([*;!$([#7,#8])])[O][#6][*;!$([#7,#8])])]
Family 70CT
EndFeature
DefineFeature @atom:125 [$([CH1D4]([*;!$([#7,#8])])[O][#6][*;!$([#7,#8])])]
Family 71CT
EndFeature
DefineFeature @atom:126 [$([CH0D4]([*;!$([#7,#8])])[O][#6][*;!$([#7,#8])])]
Family 72CT
EndFeature
DefineFeature @atom:127 [$([#1][#6]([*;!$([#7,#8])])[O][#6][*;!$([#7,#8])])]
Family 73HC
EndFeature
DefineFeature @atom:128 [$([O](C)[#6][O][#6])]
Family 74OS
EndFeature
DefineFeature @atom:129 [$([OH][C][O][#6])]
Family 75OH
EndFeature
DefineFeature @atom:130 [$([#1][O][C][O][#6])]
Family 76HO
EndFeature
DefineFeature @atom:131 [$([CH2D4]([O][#6])[O][#6])]
Family 77CO
EndFeature
DefineFeature @atom:132 [$([#1][CH2D4]([O][#6])[O][#6])]
Family 78HC
EndFeature
DefineFeature @atom:133 [$([CH2D4]([OH])[O][#6])]
Family 79CO
EndFeature
DefineFeature @atom:134 [$([#1][CH2D4]([OH])[O][#6])]
Family 80HC
EndFeature
DefineFeature @atom:135 [$([CH1D4]([O][#6])[O][#6])]
Family 81CO
EndFeature
DefineFeature @atom:136 [$([#1][CH1D4]([O][#6])[O][#6])]
Family 82HC
EndFeature
DefineFeature @atom:137 [$([CH1D4]([OH])[O][#6])]
Family 83CO
EndFeature
DefineFeature @atom:138 [$([#1][CH1D4]([OH])[O][#6])]
Family 84HC
EndFeature
DefineFeature @atom:139 [$([CH0D4]([O][#6])[O][#6])]
Family 85CO
EndFeature
DefineFeature @atom:140 [$([CH0D4]([OH])[O][#6])]
Family 86CO
EndFeature
DefineFeature @atom:141 [$([c][O][#6])]
Family 87CA
EndFeature
DefineFeature @atom:142 [#16D2H1]
Family 88SH
EndFeature
DefineFeature @atom:143 [#16D2H2]
Family 89SH
EndFeature
DefineFeature @atom:144 [$([#16H0]~[#6])]
Family 90S
EndFeature
DefineFeature @atom:145 [$([#16D2H0][#16D2H0])]
Family 91S
EndFeature
DefineFeature @atom:146 [$([#1][SD2H1])]
Family 92HS
EndFeature
DefineFeature @atom:147 [$([#1][SD2H2])]
Family 93HS
EndFeature
DefineFeature @atom:148 [$([CH2][#16H1])]
Family 94CT
EndFeature
DefineFeature @atom:149 [$([CH1][#16H1])]
Family 95CT
EndFeature
DefineFeature @atom:150 [$([CH0][#16H1])]
Family 96CT
EndFeature
DefineFeature @atom:151 [$([CH3][#16D2H0])]
Family 97CT
EndFeature
DefineFeature @atom:152 [$([CH2][#16D2H0])]
Family 98CT
EndFeature
DefineFeature @atom:153 [$([CH1][#16D2H0])]
Family 99CT
EndFeature
DefineFeature @atom:154 [$([CH0][#16D2H0])]
Family 100CT
EndFeature
DefineFeature @atom:155 [$([CH3][#16D2H0][#16D2H0])]
Family 101CT
EndFeature
DefineFeature @atom:156 [$([CH2][#16D2H0][#16D2H0])]
Family 102CT
EndFeature
DefineFeature @atom:157 [$([CH1][#16D2H0][#16D2H0])]
Family 103CT
EndFeature
DefineFeature @atom:158 [$([CH0][#16D2H0][#16D2H0])]
Family 104CT
EndFeature
DefineFeature @atom:159 [$([CH3][SH1])]
Family 105CT
EndFeature
DefineFeature @atom:160 [$([CH2](c)[OH])]
Family 106CT
EndFeature
DefineFeature @atom:161 [$([CH1](c)[OH])]
Family 107CT
EndFeature
DefineFeature @atom:162 [$([CH0](c)[OH])]
Family 108CT
EndFeature
DefineFeature @atom:163 [$([c][CH2][OH])]
Family 109CA
EndFeature
DefineFeature @atom:164 [$([SD2]([c])[CH3])]
Family 110S
EndFeature
DefineFeature @atom:165 [$([CH2D4][NH2])]
Family 111CT
EndFeature
DefineFeature @atom:166 [$([CH1D4][NH2])]
Family 112CT
EndFeature
DefineFeature @atom:167 [$([CH0D4][NH2])]
Family 113CT
EndFeature
DefineFeature @atom:168 [$([Cl][CD3])]
Family 114Cl
EndFeature
DefineFeature @atom:169 [$([CD3][F,Cl,Br,I])]
Family 115CM
EndFeature
DefineFeature @atom:170 [$([c][SD2][CH3])]
Family 116CA
EndFeature
DefineFeature @atom:171 [$([CH1D4]([N][C]=[O]))]
Family 117CT
EndFeature
DefineFeature @atom:172 [$([CH0D4]([N][C]=[O]))]
Family 118CT
EndFeature
DefineFeature @atom:173 [$([C]([c])([c])=[O])]
Family 119C
EndFeature
DefineFeature @atom:174 [$([CH1]([c])=[O])]
Family 120C_2
EndFeature
DefineFeature @atom:175 [$([C]([c])([CH3])=[O])]
Family 121C_2
EndFeature
DefineFeature @atom:176 [$([C]([c])([NH2D3])=[O])]
Family 122C
EndFeature
DefineFeature @atom:177 [$([CD3](=O)[ND3])]
Family 123C
EndFeature
DefineFeature @atom:178 [$([O]=[CD3][ND3])]
Family 124O
EndFeature
DefineFeature @atom:179 [$([ND3H2][CD3]=[O])]
Family 125N
EndFeature
DefineFeature @atom:180 [$([ND3H1][CD3]=[O])]
Family 126N
EndFeature
DefineFeature @atom:181 [$([ND3H0][CD3]=[O])]
Family 127N
EndFeature
DefineFeature @atom:182 [$([#1][ND3H2][CD3]=[O])]
Family 128H
EndFeature
DefineFeature @atom:183 [$([#1][ND3H1][CD3]=[O])]
Family 129H
EndFeature
DefineFeature @atom:184 [$([CH3D4][NH1D3][CD3]=[O])]
Family 130CT
EndFeature
DefineFeature @atom:185 [$([CH3D4][NH0D3][CD3]=[O])]
Family 131CT
EndFeature
DefineFeature @atom:186 [$([CH2D4][NH1D3][CD3]=[O])]
Family 132CT
EndFeature
DefineFeature @atom:187 [$([CH2D4][NH0D3][CD3]=[O])]
Family 133CT_3
EndFeature
DefineFeature @atom:188 [$([CH1D4][NH0D3][CD3]=[O])]
Family 134CT_2
EndFeature
DefineFeature @atom:189 [$([CD3](=O)([NH2D3])[NH2D3])]
Family 135C
EndFeature
DefineFeature @atom:190 [$([O]=[CD3]([NH2D3])[NH2D3])]
Family 136O
EndFeature
DefineFeature @atom:191 [$([NH2D3][CD3]([NH2D3])=[O])]
Family 137N
EndFeature
DefineFeature @atom:192 [$([#1][NH2D3][CD3]([NH2D3])=[O])]
Family 138H
EndFeature
DefineFeature @atom:193 [$([ND3]([CD3]=[O])[CD3]=[O])]
Family 139N
EndFeature
DefineFeature @atom:194 [$([CD3](=[O])[ND3][CD3]=[O])]
Family 140C
EndFeature
DefineFeature @atom:195 [$([O]=[CD3][ND3][CD3]=[O])]
Family 141O
EndFeature
DefineFeature @atom:196 [$([#1][ND3]([CD3]=[O])[CD3]=[O])]
Family 142H
EndFeature
DefineFeature @atom:197 [$([#1][CD3](=[O])[ND3][CD3]=[O])]
Family 143HC
EndFeature
DefineFeature @atom:198 [$([CH3D4][CD3](=[O])[ND3][CD3]=[O])]
Family 144CT
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DefineFeature @atom:199 [$([CH2D4][CD3](=[O])[ND3][CD3]=[O])]
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EndFeature
DefineFeature @atom:200 [$([CH1D4][CD3](=[O])[ND3][CD3]=[O])]
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EndFeature
DefineFeature @atom:201 [$([CH0D4][CD3](=[O])[ND3][CD3]=[O])]
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EndFeature
DefineFeature @atom:202 [$([c][CD2]#[ND1])]
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EndFeature
DefineFeature @atom:203 [$([CD2](c)#[ND1])]
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EndFeature
DefineFeature @atom:204 [$([ND1]#[CD2][c])]
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EndFeature
DefineFeature @atom:205 [$([c][Cl])]
Family 151CA
EndFeature
DefineFeature @atom:206 [$([Cl][c])]
Family 152Cl
EndFeature
DefineFeature @atom:207 [$([NH1D3](c)[CD3]=[O])]
Family 153N
EndFeature
DefineFeature @atom:208 [$([c][NH1D3][CD3]=[O])]
Family 154CA
EndFeature
DefineFeature @atom:209 [$([CD3](=O)[OH])]
Family 155C
EndFeature
DefineFeature @atom:211 [$([OH][CD3]=[O])]
Family 156OH
EndFeature
DefineFeature @atom:210 [$([O]=[CD3][OH])]
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EndFeature
DefineFeature @atom:212 [$([#1][O][CD3]=[O])]
Family 158HO
EndFeature
DefineFeature @atom:213 [$([#6](~[#8D1])~[#8D1])]
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EndFeature
DefineFeature @atom:214 [$([#8D1]~[#6]~[#8D1])]
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EndFeature
DefineFeature @atom:215 [$([CH3D4][#6D3](~[#8D1])~[#8D1])]
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EndFeature
DefineFeature @atom:216 [$([CH2D4][#6D3](~[#8D1])~[#8D1])]
Family 162CT
EndFeature
DefineFeature @atom:217 [$([CH1D4][#6D3](~[#8D1])~[#8D1])]
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EndFeature
DefineFeature @atom:218 [$([CH0D4][#6D3](~[#8D1])~[#8D1])]
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EndFeature
DefineFeature @atom:219 [$([CH1]([#6])=[O])]
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EndFeature
DefineFeature @atom:220 [$([O]=[CH1][#6])]
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EndFeature
DefineFeature @atom:221 [$([#1][CH1]([#6])=[O])]
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EndFeature
DefineFeature @atom:221 [$([#1][CH1]([#7])=[O])]
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EndFeature
DefineFeature @atom:222 [$([CH0D3]([#6])([#6])=[O])]
Family 169C_2
EndFeature
DefineFeature @atom:223 [$([O]=[CH0D3]([#6])[#6])]
Family 170O_2
EndFeature
DefineFeature @atom:224 [$([#1][CD4][CH0D3](=[O])[#6])]
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EndFeature
DefineFeature @atom:224 [$([#1][CD4][CH1D3](=[O]))]
Family 172HC
EndFeature
DefineFeature @atom:229 [$([#7H4D4])]
Family 173N3
EndFeature
DefineFeature @atom:230 [$([#7H3D4])]
Family 174N3
EndFeature
DefineFeature @atom:231 [$([#7H0D4])]
Family 175N3
EndFeature
DefineFeature @atom:232 [$([#1][#7H4D4])]
Family 176H3
EndFeature
DefineFeature @atom:233 [$([#1][#7H3D4])]
Family 177H3
EndFeature
DefineFeature @atom:234 [$([CH3D4][#7H3D4])]
Family 178CT
EndFeature
DefineFeature @atom:235 [$([CH2D4][#7H3D4])]
Family 179CT
EndFeature
DefineFeature @atom:235 [$([CH2D4]([CD3]=[O])[#7H3D4])]
Family 180CT_2
EndFeature
DefineFeature @atom:240 [$([CH3D4][#7H2D4])]
Family 181CT
EndFeature
DefineFeature @atom:241 [$([CH2D4]([#7D4])[#6D3]([#8D1])[#8D1])]
Family 182CT_2
EndFeature
DefineFeature @atom:242 [$([CH1D4]([CH3D4])([#7D4])[#6D3]([#8D1])[#8D1])]
Family 183CT_2
EndFeature
DefineFeature @atom:243 [$([#7H2D3]~[#6H0D3](~[#7D3])~[#7D3])]
Family 184N2
EndFeature
DefineFeature @atom:244 [$([#1][#7H2D3]~[#6H0D3](~[#7D3])~[#7D3])]
Family 185H3
EndFeature
DefineFeature @atom:245 [$([#6H0D3](~[#7D3])(~[#7D3])~[#7D3])]
Family 186CA
EndFeature
DefineFeature @atom:246 [$([#7H1D3]~[#6H0D3](~[#7D3])~[#7D3])]
Family 187N2
EndFeature
DefineFeature @atom:247 [$([#1][#7H1D3]~[#6H0D3](~[#7D3])~[#7D3])]
Family 188H3
EndFeature
DefineFeature @atom:248 [$([CH3D4][#7H1D3]~[#6H0D3](~[#7D3])~[#7D3])]
Family 189CT
EndFeature
DefineFeature @atom:249 [$([CH3D4][CH2D4][#7H1D3]~[#6H0D3](~[#7D3])~[#7D3])]
Family 190CT
EndFeature
DefineFeature @atom:250 [$([CH2D4][#7H1D3]~[#6H0D3](~[#7D3])~[#7D3])]
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EndFeature
DefineFeature @atom:251 [$([CH2D4]([CH2D4][CH1D4])[CH2D4][#7H1D3]~[#6H0D3](~[#7D3])~[#7D3])]
Family 192CT
EndFeature
DefineFeature @atom:252 [$([#7H2D4])]
Family 193N3
EndFeature
DefineFeature @atom:253 [$([#1][#7H2D4])]
Family 194H3
EndFeature
DefineFeature @atom:254 [$([n]([c]([NH2D3])[c])[c]([NH2D3])[c])]
Family 195NC
EndFeature
DefineFeature @atom:254 [$([#7]=[#6])]
Family 196NC
EndFeature
DefineFeature @atom:254 [$([n][n])]
Family 197NC
EndFeature
DefineFeature @atom:255 [$([c]([n][c]([NH2D3])[c])([NH2D3])[c])]
Family 198CA
EndFeature
DefineFeature @atom:256 [$([NH2D3][c][n][c][NH2D3])]
Family 199N2
EndFeature
DefineFeature @atom:257 [$([#1][NH2D3][c][n][c][NH2D3])]
Family 200H
EndFeature
DefineFeature @atom:258 [$([c](c)[c]([NH2D3])[n][c][NH2D3])]
Family 201CA
EndFeature
DefineFeature @atom:259 [$([#1][c](c)[c]([NH2D3])[n][c][NH2D3])]
Family 202HA
EndFeature
DefineFeature @atom:260 [$([c]([c][c]([NH2D3]))[c][c]([NH2D3])[n])]
Family 203CA
EndFeature
DefineFeature @atom:261 [$([#1][c]([c][c]([NH2D3]))[c][c]([NH2D3])[n])]
Family 204HA
EndFeature
DefineFeature @atom:262 [$([#7H1D3]([#6D3])[#6D3](=O)[#7D3][#6D3]=[O])]
Family 205NA
EndFeature
DefineFeature @atom:262 [$([#7H0D3]([#6D3])[#6D3](=O)[#7D3][#6D3]=[O])]
Family 206N*
EndFeature
DefineFeature @atom:263 [$([#6D3](=O)([#7D3][#6D3]=[O])[#7D3])]
Family 207C
EndFeature
DefineFeature @atom:264 [$([#7H1D3]([#6D3]=[O])[#6D3](=O)[#7D3][#6D3])]
Family 208NA
EndFeature
DefineFeature @atom:265 [$([#6D3](=O)([#6D3][#6D3])[#7D3][#6D3](=O)[#7D3])]
Family 209C
EndFeature
DefineFeature @atom:266 [$([#6D3]([#6H1D3])[#6D3](=O)[#7D3][#6D3](=O)[#7D3])]
Family 210CM
EndFeature
DefineFeature @atom:267 [$([#6H1D3]([#6D3][#6D3]=[O])[#7D3][#6D3](=O)[#7D3])]
Family 211CM
EndFeature
DefineFeature @atom:268 [$([#1][#7H1D3]([#6D3])[#6D3](=O)[#7D3][#6D3]=[O])]
Family 212H
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DefineFeature @atom:269 [$([O]=[#6D3]([#7D3][#6D3])[#7D3][#6D3]=[O])]
Family 213O
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DefineFeature @atom:270 [$([#1][#7H1D3]([#6D3]=[O])[#6D3](=O)[#7D3][#6D3])]
Family 214H
EndFeature
DefineFeature @atom:271 [$([O]=[#6D3]([#6D3])[#7D3][#6D3](=O)[#7D3])]
Family 215O
EndFeature
DefineFeature @atom:272 [$([#1][#6H1D3]([#6D3])[#6D3](=O)[#7D3][#6D3](=O)[#7D3])]
Family 216HC
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DefineFeature @atom:273 [$([#1][#6H1D3]([#6D3][#6D3]=[O])[#7D3][#6D3](=O)[#7D3])]
Family 217HC
EndFeature
DefineFeature @atom:274 [$([#6D4][#6D3]([#6D3])[#6D3](=O)[#7D3][#6D3](=O)[#7D3])]
Family 218CT
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DefineFeature @atom:275 [$([#1][#6D4][#6D3]([#6D3])[#6D3](=O)[#7D3][#6D3](=O)[#7D3])]
Family 219HC
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DefineFeature @atom:276 [$([#7H1D3]1[#6D3](=O)[#7D2][#6D3]([NH2D3])[#6D3][#6D3]1)]
Family 220NA
EndFeature
DefineFeature @atom:276 [$([#7H0D3]1[#6D3](=O)[#7D2][#6D3]([NH2D3])[#6D3][#6D3]1)]
Family 221N*
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DefineFeature @atom:277 [$([#6D3]1(=O)[#7D2][#6D3]([NH2D3])[#6D3][#6D3][#7D3]1)]
Family 222C
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DefineFeature @atom:278 [$([#7D2]1[#6D3](=O)[#7D3][#6D3][#6D3][#6D3]1[NH2D3])]
Family 223NC
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DefineFeature @atom:279 [$([#6D3]1([NH2D3])[#6D3][#6D3][#7D3][#6D3](=O)[#7D2]1)]
Family 224CA
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DefineFeature @atom:280 [$([#6D3]1[#6D3]([NH2D3])[#7D2][#6D3](=O)[#7D3][#6D3]1)]
Family 225CM
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DefineFeature @atom:281 [$([#6D3]1[#6D3][#6D3]([NH2D3])[#7D2][#6D3](=O)[#7D3]1)]
Family 226CM
EndFeature
DefineFeature @atom:282 [$([#1][#7H1D3]1[#6D3](=O)[#7D2][#6D3]([NH2D3])[#6D3][#6D3]1)]
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DefineFeature @atom:283 [$([O]=[#6D3]1[#7D2][#6D3]([NH2D3])[#6D3][#6D3][#7D3]1)]
Family 228O
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DefineFeature @atom:284 [$([NH2D3][#6D3]1[#6D3][#6D3][#7D3][#6D3](=O)[#7D2]1)]
Family 229N2
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DefineFeature @atom:285 [$([#1][NH2D3][#6D3]1[#6D3][#6D3][#7D3][#6D3](=O)[#7D2]1)]
Family 230H
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DefineFeature @atom:286 [$([#1][NH2D3][#6D3]1[#6D3][#6D3][#7D3][#6D3](=O)[#7D2]1)]
Family 231H
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DefineFeature @atom:287 [$([#1][#6D3]1[#6D3]([NH2D3])[#7D2][#6D3](=O)[#7D3][#6D3]1)]
Family 232HC
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DefineFeature @atom:288 [$([#1][#6D3]1[#6D3][#6D3]([NH2D3])[#7D2][#6D3](=O)[#7D3]1)]
Family 233H4
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DefineFeature @atom:289 [$([#7]1[#6][#7][#6]2[#6]([#7][#6][#7]2)[#6]1([NH2D3]))]
Family 234NC
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DefineFeature @atom:290 [$([#6]1[#7][#6]2[#6]([#7][#6][#7]2)[#6]([NH2D3])[#7]1)]
Family 235CQ
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DefineFeature @atom:291 [$([#7]1[#6]2[#6]([#7][#6][#7]2)[#6]([NH2D3])[#7][#6]1)]
Family 236NC
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DefineFeature @atom:292 [$([#6]1([#7][#6][#7]2)[#6]2[#6]([NH2D3])[#7][#6][#7]1)]
Family 237CB
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DefineFeature @atom:293 [$([#6]1([#7][#6][#7]2)[#6]2[#7][#6][#7][#6]1([NH2D3]))]
Family 238CB
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DefineFeature @atom:294 [$([#6]1([NH2D3])[#7][#6][#7][#6]2[#6]1([#7][#6][#7]2))]
Family 239CA
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DefineFeature @atom:295 [$([#7]1[#6][#7][#6]2[#6]1[#6][#7][#6][#7]2)]
Family 240NB
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DefineFeature @atom:296 [$([#6]1[#7][#6]2[#7][#6][#7][#6][#6]2[#7]1)]
Family 241CK
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DefineFeature @atom:297 [$([#7D3]1[#6]2[#7][#6][#7][#6][#6]2[#7][#6]1)]
Family 242NA
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DefineFeature @atom:297 [$([#7D2D3]1[#6]2[#7][#6][#7][#6][#6]2[#7][#6]1)]
Family 243N*
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DefineFeature @atom:298 [$([#1][#6]1[#7][#6]2[#6]([#7][#6][#7]2)[#6]([NH2D3])[#7]1)]
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DefineFeature @atom:299 [$([NH2D3][#6]1[#7][#6][#7][#6]2[#6]1([#7][#6][#7]2))]
Family 245N2
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DefineFeature @atom:300 [$([#1][NH2D3][#6]1[#7][#6][#7][#6]2[#6]1([#7][#6][#7]2))]
Family 246H
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DefineFeature @atom:301 [$([#1][NH2D3][#6]1[#7][#6][#7][#6]2[#6]1([#7][#6][#7]2))]
Family 247H
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DefineFeature @atom:302 [$([#1][#6]1[#7][#6]2[#7][#6][#7][#6][#6]2[#7]1)]
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DefineFeature @atom:303 [$([#1][#7D3]1[#6]2[#7][#6][#7][#6][#6]2[#7][#6]1)]
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DefineFeature @atom:304 [$([#7H1]1[#6](=[#8])[#6]([#7H0][#6][#7H1]2)[#6]2[#7H0][#6]1[NH2D3])]
Family 250NA
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DefineFeature @atom:305 [$([#6]1([NH2D3])[#7H1][#6](=[#8])[#6]([#7H0][#6][#7H1]2)[#6]2[#7H0]1)]
Family 251CA
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DefineFeature @atom:306 [$([#7H0]1[#6]([#7H1][#6][#7H0]2)[#6]2[#6](=[#8])[#7H1][#6]1[NH2D3])]
Family 252NC
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DefineFeature @atom:307 [$([#6]1([#7H1][#6][#7H0]2)[#6]2[#6](=[#8])[#7H1][#6]([NH2D3])[#7H0]1)]
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DefineFeature @atom:308 [$([#6]1([#7H0][#6][#7H1]2)[#6]2[#7H0][#6]([NH2D3])[#7H1][#6]1(=[#8]))]
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DefineFeature @atom:309 [$([#6]1(=[#8])[#6]([#7H0][#6][#7H1]2)[#6]2[#7H0][#6]([NH2D3])[#7H1]1)]
Family 255C
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DefineFeature @atom:310 [$([#1][#7H1]1[#6](=[#8])[#6]([#7H0][#6][#7H1]2)[#6]2[#7H0][#6]1[NH2D3])]
Family 256H
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DefineFeature @atom:311 [$([NH2D3][#6]1[#7H1][#6](=[#8])[#6]([#7H0][#6][#7H1]2)[#6]2[#7H0]1)]
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DefineFeature @atom:312 [$([#1][NH2D3][#6]1[#7H1][#6](=[#8])[#6]([#7H0][#6][#7H1]2)[#6]2[#7H0]1)]
Family 258H
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DefineFeature @atom:313 [$([#8]=[#6]1[#6]([#7H0][#6][#7H1]2)[#6]2[#7H0][#6]([NH2D3])[#7H1]1)]
Family 259O
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DefineFeature @atom:314 [$([CD4][nD3]1c2ncncc2nc1)]
Family 260CT
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DefineFeature @atom:315 [$([#1][CD4][nD3]1c2ncncc2nc1)]
Family 261HC
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DefineFeature @atom:316 [$([CD4][#7D3]([#6D3])[#6D3](=O)[#7D3][#6D3]=[O])]
Family 262CT
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DefineFeature @atom:317 [$([#1][CD4][#7D3]([#6D3])[#6D3](=O)[#7D3][#6D3]=[O])]
Family 263HC
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DefineFeature @atom:318 [$([CD4][#7D3]([#6D3])[#6D3](=O)[#7D2][#6D3][NH2D3])]
Family 264CT
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DefineFeature @atom:319 [$([#1][CD4][#7D3]([#6D3])[#6D3](=O)[#7D2][#6D3][NH2D3])]
Family 265HC
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DefineFeature @atom:320 [$([#7H1D3]1[#6D3](=O)[#7H1D3][#6D3]([NH2D3])[#6D3][#6D3]1)]
Family 266NA
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DefineFeature @atom:320 [$([#7H0D3]1[#6D3](=O)[#7H1D3][#6D3]([NH2D3])[#6D3][#6D3]1)]
Family 267N*
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DefineFeature @atom:321 [$([#6D3]1(=O)[#7D3][#6D3]([NH2D3])[#6D3][#6D3][#7D3]1)]
Family 268C
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DefineFeature @atom:322 [$([#7D3]1[#6D3](=O)[#7D3][#6D3][#6D3][#6D3]1[NH2D3])]
Family 269NA
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DefineFeature @atom:323 [$([#6D3]1([NH2D3])[#6D3][#6D3][#7D3][#6D3](=O)[#7D3]1)]
Family 270CA
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DefineFeature @atom:324 [$([#6D3]1[#6D3]([NH2D3])[#7D3][#6D3](=O)[#7D3][#6D3]1)]
Family 271CM
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DefineFeature @atom:325 [$([#6D3]1[#6D3][#6D3]([NH2D3])[#7D3][#6D3](=O)[#7D3]1)]
Family 272CM
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DefineFeature @atom:326 [$([#1][#7H1D3]1[#6D3](=O)[#7H1D3][#6D3]([NH2D3])[#6D3][#6D3]1)]
Family 273H
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DefineFeature @atom:327 [$([O]=[#6D3]1[#7D3][#6D3]([NH2D3])[#6D3][#6D3][#7D3]1)]
Family 274O
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DefineFeature @atom:328 [$([#1][#7D3]1[#6D3](=O)[#7D3][#6D3][#6D3][#6D3]1[NH2D3])]
Family 275H
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DefineFeature @atom:329 [$([NH2D3][#6D3]1[#6D3][#6D3][#7D3][#6D3](=O)[#7D3]1)]
Family 276N2
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DefineFeature @atom:330 [$([#1][NH2D3][#6D3]1[#6D3][#6D3][#7D3][#6D3](=O)[#7D3]1)]
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DefineFeature @atom:331 [$([#1][NH2D3][#6D3]1[#6D3][#6D3][#7D3][#6D3](=O)[#7D3]1)]
Family 278H
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DefineFeature @atom:332 [$([#1][#6D3]1[#6D3]([NH2D3])[#7D3][#6D3](=O)[#7D3][#6D3]1)]
Family 279HA
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DefineFeature @atom:333 [$([#1][#6D3]1[#6D3][#6D3]([NH2D3])[#7D3][#6D3](=O)[#7D3]1)]
Family 280H4
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DefineFeature @atom:334 [$([CD4][#7H0D3]1[#6D3](=O)[#7H1D3][#6D3]([NH2D3])[#6D3][#6D3]1)]
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DefineFeature @atom:335 [$([#1][CD4][#7H0D3]1[#6D3](=O)[#7H1D3][#6D3]([NH2D3])[#6D3][#6D3]1)]
Family 282HC
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DefineFeature @atom:343 [F-]
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DefineFeature @atom:344 [Cl-]
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DefineFeature @atom:345 [Br-]
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DefineFeature @atom:346 [I-]
Family 286I-
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DefineFeature @atom:348 [Li+]
Family 287Li+
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DefineFeature @atom:349 [Na+]
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DefineFeature @atom:350 [K+]
Family 289K+
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DefineFeature @atom:351 [Rb+]
Family 290Rb+
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DefineFeature @atom:352 [Cs+]
Family 291Cs+
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DefineFeature @atom:353 [Mg+2]
Family 292Mg2+
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DefineFeature @atom:354 [Ca+2]
Family 293Ca2+
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DefineFeature @atom:355 [Sr+2]
Family 294Sr2+
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DefineFeature @atom:356 [Ba+2]
Family 295Ba2+
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DefineFeature @atom:357 [$([CH3D4][S-])]
Family 296C3
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DefineFeature @atom:358 [$([#1][CH3D4][S-])]
Family 297HC
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DefineFeature @atom:359 [$([S-][CH3D4])]
Family 298SH
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DefineFeature @atom:360 [$([CH3D4][O-])]
Family 299C3
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DefineFeature @atom:361 [$([#1][CH3D4][O-])]
Family 300HC
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DefineFeature @atom:362 [$([O-][CH3D4])]
Family 301OH
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DefineFeature @atom:363 [$([CH2D3][CH0D2][ND1])]
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DefineFeature @atom:364 [$([#1][CH2D3][CH0D2][ND1])]
Family 303HC
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DefineFeature @atom:365 [$([CH0D2]([CH2D3])[ND1])]
Family 304CZ
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DefineFeature @atom:366 [$([ND1][CH0D2][CH2D3])]
Family 305NZ
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DefineFeature @atom:367 [$([CH3D3][NH1D2])]
Family 306C3
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DefineFeature @atom:368 [$([#1][CH3D3][NH1D2])]
Family 307HC
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DefineFeature @atom:369 [$([NH1D2][CH3D3])]
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DefineFeature @atom:370 [$([#1][NH1D2][CH3D3])]
Family 309H
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DefineFeature @atom:371 [$([CH2D3-])]
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Family 311HC
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DefineFeature @atom:373 [$([CH3D4][CH2D3-])]
Family 312CT
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DefineFeature @atom:374 [$([#1][CH3D4][CH2D3-])]
Family 313HC
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DefineFeature @atom:376 [$([OH1D1-])]
Family 314OH
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DefineFeature @atom:377 [$([#1][OH1D1-])]
Family 315HO
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DefineFeature @atom:381 [$([PD4]([OD2])([OD2])(=[O,S])-[O,S])]
Family 316P
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DefineFeature @atom:382 [$([O]=[PD4]([OD2])([OD2])-[O,S])]
Family 317O2
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DefineFeature @atom:383 [$([O]([#6])[PD4]([OD2])(=[O,S])-[O,S])]
Family 318OS
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DefineFeature @atom:384 [$([#6][O][PD4]([OD2])(=[O,S])-[O,S])]
Family 319CT
EndFeature
DefineFeature @atom:385 [$([#1][#6][O][PD4]([OD2])(=[O,S])-[O,S])]
Family 320HC
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DefineFeature @atom:386 [$([PD4]([OD2])(=[O,S])(-[O,S])-[O,S])]
Family 321P
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DefineFeature @atom:387 [$([O]=[PD4]([OD2])(-[O,S])-[O,S])]
Family 322O2
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DefineFeature @atom:388 [$([O]([#6])[PD4](=[O,S])(-[O,S])-[O,S])]
Family 323OS
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DefineFeature @atom:389 [$([#6][O][PD4](=[O,S])(-[O,S])-[O,S])]
Family 324CT
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DefineFeature @atom:390 [$([#1][#6][O][PD4](=[O,S])(-[O,S])-[O,S])]
Family 325HC
EndFeature
DefineFeature @atom:391 [$([PD4]([#6])(=[O,S])(-[O,S])[OD2])]
Family 326P
EndFeature
DefineFeature @atom:392 [$([O]=[PD4]([#6])(-[O,S])[OD2])]
Family 327O2
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DefineFeature @atom:393 [$([O]([#6])[PD4]([#6])(=[O,S])-[O,S])]
Family 328OS
EndFeature
DefineFeature @atom:394 [$([#6][O][PD4]([#6])(=[O,S])-[O,S])]
Family 329CT
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DefineFeature @atom:395 [$([#1][#6][O][PD4]([#6])(=[O,S])-[O,S])]
Family 330HC
EndFeature
DefineFeature @atom:396 [$([#6][PD4](=[O,S])(-[O,S])[OD2])]
Family 331CT
EndFeature
DefineFeature @atom:397 [$([#1][#6][PD4](=[O,S])(-[O,S])[OD2])]
Family 332HC
EndFeature