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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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378125 134224198 1 ClN2O3F4H13C21 AB2C3D4E13F21 -234.64 4.78 -9.32 -1.29 0
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378126 134224199 1 ClFO3C32H34 ABC3D32E34 -105.3 6.28 -9.38 -0.56 0
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378127 134224200 1 ClOH17C18 ABC17D18 25.06 1.86 -9.21 -0.28 0
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378128 134224201 1 FNCl2O3H14C21 ABC2D3E14F21 -85.49 4.39 -8.93 -1.18 0
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378129 134224202 1 FNCl2O4H12C23 ABC2D4E12F23 -104.62 5.41 -9.34 -1.85 0
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378130 134224203 1 Cl2O3C30H30 A2B3C30D30 -81.25 8.54 -9.39 -0.93 0
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378131 134224205 1 ClF3N3O3H13C21 AB3C3D3E13F21 -166.52 7.86 -9.05 -1.65 0
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378132 134224206 1 FNCl2O3H18C23 ABC2D3E18F23 -99.66 3.68 -8.53 -0.9 0
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378133 134224207 1 FNCl2O3H22C26 ABC2D3E22F26 -106.27 4.7 -8.81 -0.81 0
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378134 134224208 1 SN4H46C58 AB4C46D58 238.18 3.1 -8.45 -0.86 0
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378135 134224209 1 N4H38C53 A4B38C53 260.74 1.4 -7.79 -1.23 0
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378136 134224210 1 N4H32C47 A4B32C47 287.55 0.99 -8.5 -1.14 0
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378137 134224211 1 ClN4O4H19C21 AB4C4D19E21 -14.89 4.33 -8.96 -0.84 0
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378138 134224212 1 NC30H33 AB30C33 77.06 3.98 -8.55 -0.42 0
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378139 134224213 1 NO6C20H25 AB6C20D25 -256.07 1.0 -10.07 -1.59 0
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378140 134224214 1 O16C23H34 A16B23C34 -689.52 4.26 -9.97 -0.48 0
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378141 134224215 1 O17C30H40 A17B30C40 -718.79 1.89 -8.98 -0.57 0
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378142 134224216 1 O17C30H40 A17B30C40 -714.82 5.9 -8.82 -0.73 0
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378143 134224217 1 O5C29H30 A5B29C30 -151.42 9.43 -8.82 -1.45 0
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378144 134224218 1 NC24H29 AB24C29 50.15 2.04 -8.4 -1.16 0
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378145 134224219 1 FN3O3H24C25 AB3C3D24E25 -31.2 6.0 -9.09 -1.28 0
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378146 134224220 1 O5H26C27 A5B26C27 -140.89 11.63 -8.78 -1.42 0
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378147 134224221 1 FN4O4C32H33 AB4C4D32E33 -85.6 3.88 -8.94 -0.96 0
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378148 134224222 1 O7C60H64 A7B60C64 -172.68 8.51 -8.83 -0.88 0
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378149 134224223 1 O3N4C33H34 A3B4C33D34 17.57 5.34 -8.55 -0.64 0
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378150 134224224 1 SN2O2H18C22 AB2C2D18E22 37.49 7.58 -8.19 -0.76 0
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378151 134224225 1 FO2N4C32H37 AB2C4D32E37 27.56 2.47 -8.62 -0.62 0
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378152 134224226 2 O11C21H28 A11B21C28 -941.13 3.48 -9.28 -0.35 0
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378153 134224227 1 O11C18H26 A11B18C26 -477.97 1.72 -10.03 -0.47 0
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378154 134224228 1 FNO2C24H26 ABC2D24E26 -88.96 4.02 -8.43 -0.76 0
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378155 134224229 1 NSF4O4H21C22 ABC4D4E21F22 -292.85 0.99 -8.79 -1.63 0
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378156 134224230 1 ClO3N7C25H26 AB3C7D25E26 -29.68 7.36 -8.06 -0.63 0
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378157 134224231 1 ON3C12H17 AB3C12D17 -24.15 3.99 -8.13 0.14 0
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378158 134224232 1 ClO3N6H19C22 AB3C6D19E22 -17.54 8.48 -8.78 -1.04 0
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378159 134224233 1 ClO3N6H19C21 AB3C6D19E21 -23.43 5.49 -8.82 -1.22 0
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378160 134224234 1 ClO2N7H18C19 AB2C7D18E19 27.32 6.01 -8.22 -0.69 0
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378161 134224235 1 ClO2N7H22C23 AB2C7D22E23 34.93 10.08 -8.25 -0.81 0
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378162 134224236 1 ClF2O2N6H19C22 AB2C2D6E19F22 -78.33 2.09 -8.44 -1.16 0
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378163 134224237 1 O3N8H20C22 A3B8C20D22 34.82 6.78 -8.57 -1.6 0
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378164 134224238 2 ON4H8C10 AB4C8D10 82.43 5.01 -8.51 -1.66 0
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378165 134224239 1 ClO2N7H18C21 AB2C7D18E21 46.68 3.62 -8.58 -1.24 0
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378166 134224240 2 ON4C12H12 AB4C12D12 68.14 8.21 -8.31 -1.44 0
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378167 134224241 1 ClO3N7H20C21 AB3C7D20E21 -14.46 3.19 -9.01 -1.39 0
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378168 134224242 1 ClO3N6H21C23 AB3C6D21E23 -29.65 7.93 -8.69 -0.95 0
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378169 134224244 1 N2O4C9H14 A2B4C9D14 -165.33 4.07 -8.94 0.35 0
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378170 134224245 1 FPN3O8C13H17 ABC3D8E13F17 -441.76 1.45 -10.22 -0.79 0
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378171 134224246 1 FPN3O9C20H23 ABC3D9E20F23 -457.63 10.06 -9.85 -0.62 1
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378172 134224248 1 PO3N5C14H15 AB3C5D14E15 -92.97 4.52 0.0 0.0 0
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378173 134224249 1 PF3N3O9C22H25 AB3C3D9E22F25 -564.9 3.92 -9.45 -1.42 0
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378174 134224250 1 ClFN2O4C9H12 ABC2D4E9F12 -214.94 5.69 -9.31 -0.4 0
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378175 134224251 1 PN3O10C25H34 AB3C10D25E34 -485.05 1.84 -9.63 -0.51 0
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378176 134224252 1 PN3O9C21H24 AB3C9D21E24 -362.3 4.94 -9.84 -0.72 0
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378177 134224253 1 PN3O9C21H26 AB3C9D21E26 -405.14 8.66 -9.85 -0.42 0
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378178 134224254 1 PN3O9C22H26 AB3C9D22E26 -367.11 3.2 -9.56 -0.55 0
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378179 134224255 1 PN3O10C22H30 AB3C10D22E30 -472.27 5.32 -9.63 -0.48 0
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378180 134224256 1 PF3N3O9C22H23 AB3C3D9E22F23 -534.47 6.16 -9.6 -0.81 0
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378181 134224257 1 NC13H23 AB13C23 -5.38 2.26 -8.16 0.93 0
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378182 134224258 2 OC13H22 AB13C22 -170.52 3.59 -10.05 3.0 1
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378183 134224259 1 NPF5O6C15H16 ABC5D6E15F16 -478.6 5.21 0.0 0.0 0
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378184 134224260 1 NOC11H15 ABC11D15 -8.26 4.45 -9.42 0.59 0
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378185 134224261 1 O3N7C23H25 A3B7C23D25 -5.59 7.19 -8.21 -0.75 0
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378186 134224262 1 F3O3N6H23C24 A3B3C6D23E24 -187.97 9.44 -8.96 -1.41 0
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378187 134224263 1 BrNO2C11H12 ABC2D11E12 -46.43 4.86 -9.58 -1.1 0
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378188 134224264 1 ClO2F3N4H14C16 AB2C3D4E14F16 -167.02 6.89 -9.81 -1.21 0
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378189 134224265 1 ClN3O3H8C12 AB3C3D8E12 -43.09 4.64 -9.52 -1.95 0
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378190 134224266 1 ClO2N4H13C14 AB2C4D13E14 -4.68 7.37 -8.97 -1.01 0
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378191 134224267 1 ClO2N7H22C24 AB2C7D22E24 59.37 6.72 -8.39 -1.19 0
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378192 134224268 1 O3N6C23H24 A3B6C23D24 -19.25 5.73 -7.99 -0.74 0
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378193 134224269 1 ClF2O3N6H17C21 AB2C3D6E17F21 -116.81 8.69 -8.6 -0.96 0
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378194 134224270 1 O3N7H21C22 A3B7C21D22 -18.49 8.57 -8.21 -0.86 0
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378195 134224271 1 ClF2O2N7H18C21 AB2C2D7E18F21 -71.38 7.53 -8.45 -1.0 0
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378196 134224272 1 O3N7H19C21 A3B7C19D21 -12.21 4.47 -8.54 -1.26 0
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378197 134224273 1 O3N6C22H22 A3B6C22D22 -10.86 4.91 -8.4 -0.98 0
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378198 134224274 1 ON2C13H24 AB2C13D24 -60.1 6.27 -9.44 0.92 0
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378199 134224275 1 INH12C20 ABC12D20 108.23 2.42 -8.16 -2.75 0
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378200 134224276 1 FIN2H6C8 ABC2D6E8 35.04 4.22 -8.56 -0.84 0
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378201 134224277 1 PF2N4O9C24H31 AB2C4D9E24F31 -509.27 7.99 -9.7 -0.58 0
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378202 134224278 1 PN3O10C24H32 AB3C10D24E32 -471.79 6.64 -10.01 -0.56 0
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378203 134224279 1 FPN3O9C22H27 ABC3D9E22F27 -455.37 8.0 -9.68 -0.55 0
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378204 134224280 1 FPN3O10C22H29 ABC3D10E22F29 -511.12 10.13 -9.63 -0.66 0
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378205 134224281 1 PN4O8C21H25 AB4C8D21E25 -315.25 8.77 -9.59 -0.4 0
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378206 134224282 1 PN4O9C21H29 AB4C9D21E29 -403.53 6.7 -9.45 -0.62 0
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378207 134224283 1 PO6N7C30H38 AB6C7D30E38 -180.51 3.42 -8.45 -0.59 0
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378208 134224284 1 PO5N7C26H32 AB5C7D26E32 -145.2 2.37 -8.45 -0.06 0
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378209 134224285 1 PN6O7C22H27 AB6C7D22E27 -260.77 7.75 -9.4 -0.86 0
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378210 134224286 1 O3N4C30H34 A3B4C30D34 -36.7 5.0 -8.88 -0.66 0
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378211 134224287 1 O2C15H24 A2B15C24 -121.17 2.13 -10.62 0.84 0
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378212 134224288 1 N2O3C22H22 A2B3C22D22 -25.09 6.89 -9.15 -0.9 0
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378213 134224289 1 NO3H19C23 AB3C19D23 -13.99 0.29 -9.1 -1.38 0
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378214 134224290 1 NOPC16H16 ABCD16E16 38.03 3.45 -8.79 -0.39 0
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378215 134224291 1 ClF2O3C31H31 AB2C3D31E31 -144.42 4.93 -9.46 -0.91 0
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378216 134224292 1 ClFOH16C18 ABCD16E18 -21.3 2.68 -9.42 -0.45 0
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378217 134224293 1 NCl2O3H15C22 AB2C3D15E22 -40.29 11.43 -8.75 -1.19 0
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378218 134224294 1 NF2O3H15C22 AB2C3D15E22 -11.04 7.38 -8.89 -1.29 0
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378219 134224295 1 ClFNO3H19C23 ABCD3E19F23 -90.26 2.79 -8.63 -0.8 0
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378220 134224296 1 N3C8H11 A3B8C11 67.62 3.23 -9.13 0.08 0
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378221 134224297 1 FN2O2H15C18 AB2C2D15E18 -40.75 3.73 -8.84 -1.52 0
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378222 134224298 1 FSN2O4C17H23 ABC2D4E17F23 -184.67 3.8 -9.67 -1.15 0
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378223 134224299 1 FNO3H16C22 ABC3D16E22 -69.58 9.84 -8.87 -0.75 0
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378224 134224300 1 FSN2O2C13H17 ABC2D2E13F17 -99.95 2.82 -8.63 -0.32 0