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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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65151 29204537 1 SN2O5C23H24 AB2C5D23E24 -132.24 6.01 -8.23 -0.65 0
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65152 29204538 1 SN2O5C23H24 AB2C5D23E24 -139.21 8.61 -8.02 -0.63 0
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65153 29204539 1 FSN2O5H23C24 ABC2D5E23F24 -160.85 6.02 -8.08 -0.97 0
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65154 29204540 1 N2S2O4C23H24 A2B2C4D23E24 -92.87 7.72 -8.0 -0.74 0
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65155 29204542 1 SN2O4C23H24 AB2C4D23E24 -107.68 8.62 -8.07 -0.64 0
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65156 29204543 1 SN3O4H23C24 AB3C4D23E24 -72.98 11.95 -8.23 -0.58 0
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65157 29204544 1 S2N3O6C22H23 A2B3C6D22E23 -162.79 9.85 -8.36 -1.21 0
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65158 29204545 1 N2S2O4C21H22 A2B2C4D21E22 -105.25 7.99 -8.08 -0.71 0
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65159 29204546 1 SN3O6C25H25 AB3C6D25E25 -169.86 6.04 -8.46 -0.71 0
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65160 29204548 1 SN2O5C20H20 AB2C5D20E20 -132.59 5.83 -8.43 -0.61 0
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65161 29204549 1 SN4O5H24C25 AB4C5D24E25 -87.65 5.37 -8.21 -1.09 0
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65162 29204550 1 SN3O6C25H29 AB3C6D25E29 -202.25 3.67 -8.57 -0.77 0
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65163 29204551 1 FSN2O5C23H23 ABC2D5E23F23 -180.82 8.83 -8.04 -0.62 0
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65164 29204553 1 BrFSN2O4H18C21 ABCD2E4F18G21 -135.5 7.18 -8.19 -1.21 0
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65165 29204555 1 SN3O6C24H25 AB3C6D24E25 -186.14 8.37 -8.08 -0.77 0
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65166 29204556 1 SN3O6C24H25 AB3C6D24E25 -185.2 9.47 -8.29 -0.73 0
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65167 29204558 1 SN4O4H24C25 AB4C4D24E25 -44.89 8.43 -8.29 -0.62 0
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65168 29204559 1 SN4O4H22C24 AB4C4D22E24 -40.13 9.92 -8.11 -1.09 0
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65169 29204561 1 ClO2N5H16C22 AB2C5D16E22 67.13 5.13 -9.12 -1.1 0
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65170 29204562 1 ClSN2O2H15C16 ABC2D2E15F16 -33.33 4.39 -9.3 -0.89 0
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65171 29204563 1 ClN3O3H16C18 AB3C3D16E18 -55.14 2.89 -9.17 -0.87 0
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65172 29204566 1 ClSN4O4C22H27 ABC4D4E22F27 -119.74 5.74 -8.76 -0.9 0
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65173 29204568 2 ClON2H7C9 ABC2D7E9 15.35 4.11 -9.5 -0.95 0
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65174 29204571 1 ClN2O2S2C15H19 AB2C2D2E15F19 -68.19 3.29 -8.36 -1.03 0
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65175 29204572 1 ClO2N4H19C20 AB2C4D19E20 2.73 4.52 -9.29 -0.78 0
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65176 29204573 1 ClO2N5H18C23 AB2C5D18E23 57.84 3.93 -9.49 -0.9 0
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65177 29204574 1 ClN3O5C16H18 AB3C5D16E18 -117.15 3.24 -9.98 -1.03 0
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65178 29204575 1 ClN3O5C16H18 AB3C5D16E18 -118.62 2.77 -9.96 -1.03 0
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65179 29204577 1 ClN3O5C16H18 AB3C5D16E18 -114.67 0.55 -9.89 -1.01 0
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65180 29204578 1 ClN4O4H21C25 AB4C4D21E25 -21.57 2.28 -8.28 -0.82 0
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65181 29204579 1 ClSN3O6C22H24 ABC3D6E22F24 -192.38 5.6 -9.52 -1.27 0
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65182 29204580 1 ClO2N4C21H21 AB2C4D21E21 -8.8 4.3 -9.4 -0.75 0
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65183 29204581 2 ClON2C8H9 ABC2D8E9 -33.74 4.36 -9.51 -0.72 0
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65184 29204583 1 ClSN3O6C21H24 ABC3D6E21F24 -185.25 8.87 -9.32 -0.85 0
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65185 29204584 1 ClSN3O6C21H24 ABC3D6E21F24 -191.2 7.04 -9.17 -1.11 0
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65186 29204585 1 ClS2N3O5C19H22 AB2C3D5E19F22 -142.5 5.66 -8.37 -1.02 0
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65187 29204586 1 ClS2N3O5C19H22 AB2C3D5E19F22 -144.92 4.45 -8.55 -0.92 0
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65188 29204587 1 FSCl2N3O4H16C21 ABC2D3E4F16G21 -133.52 5.0 -8.96 -1.48 0
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65189 29204589 1 ClN4O4C22H29 AB4C4D22E29 -163.21 3.55 -9.76 -0.88 0
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65190 29204590 1 ClO2N4H17C18 AB2C4D17E18 -3.25 1.11 -9.15 -0.97 0
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65191 29204591 1 ClN4O4H15C16 AB4C4D15E16 -27.92 7.5 -9.07 -1.02 0
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65192 29204592 1 ClSN4O4C23H27 ABC4D4E23F27 -117.33 6.4 -9.17 -0.9 0
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65193 29204593 1 ClSN3O4C18H18 ABC3D4E18F18 -111.98 4.89 -8.97 -0.67 0
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65194 29204594 1 ClSO2N4H19C20 ABC2D4E19F20 12.57 3.88 -8.89 -1.01 0
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65195 29204595 1 Cl2N2O4H14C17 A2B2C4D14E17 -101.79 5.0 -9.34 -0.92 0
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65196 29204596 1 FN3O3H18C19 AB3C3D18E19 -39.75 7.64 -9.39 -0.72 0
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65197 29204597 1 SCl2N3O5H15C16 AB2C3D5E15F16 -109.09 6.03 -9.75 -1.4 0
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65198 29204598 1 FN3O3H18C19 AB3C3D18E19 -40.1 5.64 -9.38 -0.7 0
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65199 29204600 1 ClSN4O4H17C19 ABC4D4E17F19 -62.91 9.14 -9.54 -1.28 0
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65200 29204601 1 ClN2O5H15C17 AB2C5D15E17 -128.01 4.84 -8.99 -0.81 0
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65201 29204604 1 N3O3C21H23 A3B3C21D23 -13.01 7.33 -8.96 -0.54 0
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65202 29204605 1 ClFO2N4H16C19 ABC2D4E16F19 -39.92 2.1 -9.45 -0.91 0
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65203 29204606 1 N3O3C21H23 A3B3C21D23 -10.65 6.27 -9.12 -0.62 0
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65204 29204607 1 ClN4O4H19C21 AB4C4D19E21 -54.6 4.07 -8.57 -0.84 0
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65205 29204608 1 N3O3C21H23 A3B3C21D23 -11.05 9.25 -9.29 -0.61 0
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65206 29204609 1 ClN4O4C17H17 AB4C4D17E17 -43.0 7.93 -9.06 -1.02 0
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65207 29204610 1 ClN3O4H16C19 AB3C4D16E19 -84.91 1.21 -9.06 -0.98 0
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65208 29204611 1 ClSN3O4C15H20 ABC3D4E15F20 -139.52 5.2 -9.37 -1.05 0
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65209 29204613 1 ClO3N4H21C25 AB3C4D21E25 8.97 1.95 -8.81 -0.8 0
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65210 29204617 1 FN3O3C20H20 AB3C3D20E20 -40.04 9.23 -9.3 -0.66 0
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65211 29204621 1 SCl2N3O5C19H19 AB2C3D5E19F19 -162.76 4.78 -9.88 -0.97 0
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65212 29204622 1 SCl2N3O5C19H19 AB2C3D5E19F19 -167.45 5.87 -9.5 -0.81 0
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65213 29204623 1 SCl2N3O5C19H19 AB2C3D5E19F19 -162.95 8.04 -9.86 -1.0 0
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65214 29204624 1 ClSN3O6C20H22 ABC3D6E20F22 -195.46 7.31 -9.45 -1.24 0
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65215 29204625 1 ClSN3O6C20H22 ABC3D6E20F22 -194.13 6.33 -9.43 -1.08 0
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65216 29204626 1 ClN3O4C18H18 AB3C4D18E18 -98.6 4.7 -9.55 -0.97 0
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65217 29204627 1 ClN2O3H25C26 AB2C3D25E26 -45.6 3.18 -8.19 -0.48 0
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65218 29204628 1 ClSN3O6H18C20 ABC3D6E18F20 -184.39 3.16 -9.71 -1.4 0
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65219 29204629 1 ClN2O3H25C26 AB2C3D25E26 -46.38 4.11 -8.19 -0.47 0
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65220 29204631 1 ClN2O3H25C26 AB2C3D25E26 -47.85 5.25 -8.3 -0.46 0
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65221 29204632 1 ClS2N3O6C18H20 AB2C3D6E18F20 -187.15 9.42 -9.05 -0.8 0
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65222 29204633 1 ClN2O3H25C26 AB2C3D25E26 -46.72 2.96 -8.21 -0.49 0
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65223 29204634 1 ClS2N3O6C18H20 AB2C3D6E18F20 -182.81 8.07 -9.39 -0.92 0
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65224 29204635 1 N2O3C23H28 A2B3C23D28 -83.9 6.69 -8.3 0.09 0
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65225 29204637 1 N2O3C23H28 A2B3C23D28 -82.58 6.03 -8.27 0.08 0
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65226 29204638 1 N2F3O3H15C18 A2B3C3D15E18 -232.16 1.9 -9.32 -0.89 0
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65227 29204639 1 ClN2O3H25C26 AB2C3D25E26 -44.23 3.72 -8.26 -0.44 0
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65228 29204640 1 ClO2F3N3H17C20 AB2C3D3E17F20 -185.11 8.18 -9.01 -0.75 0
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65229 29204642 1 N2F3O5C16H17 A2B3C5D16E17 -293.29 7.4 -9.27 -0.73 0
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65230 29204643 1 BrN2O4H23C24 AB2C4D23E24 -58.8 2.23 -8.18 -0.76 0
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65231 29204644 1 N2F3O5C16H17 A2B3C5D16E17 -294.29 7.49 -9.24 -0.74 0
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65232 29204645 1 BrN2O4H23C24 AB2C4D23E24 -59.44 4.79 -8.22 -0.8 0
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65233 29204646 1 N2F3O5C16H17 A2B3C5D16E17 -291.19 5.34 -9.4 -0.77 0
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65234 29204648 1 N2F3O5C16H17 A2B3C5D16E17 -294.09 5.94 -9.54 -0.9 0
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65235 29204650 1 O2F3N3H20C21 A2B3C3D20E21 -185.26 8.61 -8.99 -0.47 0
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65236 29204652 1 SF3N3O4H14C16 AB3C3D4E14F16 -295.15 5.53 -9.2 -0.87 -1
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65237 29204653 1 SF3N3O5H11C16 AB3C3D5E11F16 -219.67 9.0 0.0 0.0 0
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65238 29204654 1 SF3N3O5H12C16 AB3C3D5E12F16 -246.22 13.02 -9.0 -1.85 0
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65239 29204656 1 SF3N3O4H16C19 AB3C3D4E16F19 -242.73 4.67 -9.54 -1.32 0
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65240 29204657 1 SN2F3O3H17C18 AB2C3D3E17F18 -240.93 3.67 -9.02 -0.76 0
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65241 29204659 1 ClSN2F3O5H14C16 ABC2D3E5F14G16 -290.3 5.37 -9.33 -1.52 0
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65242 29204660 1 ClSN2F3O5H18C19 ABC2D3E5F18G19 -340.97 7.4 -9.36 -1.36 0
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65243 29204661 1 ClSN2F3O5H18C19 ABC2D3E5F18G19 -338.65 4.3 -9.61 -0.96 0
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65244 29204662 1 ClSN2F3O5H18C19 ABC2D3E5F18G19 -343.92 3.12 -9.33 -0.82 0
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65245 29204663 1 ClSN2F3O5H18C19 ABC2D3E5F18G19 -348.6 9.28 -9.12 -1.0 0
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65246 29204664 1 SN2F3O6C20H21 AB2C3D6E20F21 -377.35 7.71 -9.3 -0.98 0
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65247 29204665 1 SN2F3O6C20H21 AB2C3D6E20F21 -375.71 6.57 -9.18 -0.64 0
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65248 29204666 1 SN2F3O4C20H23 AB2C3D4E20F23 -298.83 5.73 -9.42 -0.79 0
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65249 29204667 1 N2S2F3O6C18H19 A2B2C3D6E18F19 -368.68 11.64 -9.0 -0.63 0
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65250 29204668 1 N2S2F3O6C18H19 A2B2C3D6E18F19 -370.18 13.56 -8.94 -0.97 0