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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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219189 85091377 1 N7O11C31H47 A7B11C31D47 -498.58 6.88 -9.71 0.03 1
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219190 85091414 1 Cl2S2N3O7C31H42 A2B2C3D7E31F42 -234.68 6.0 0.0 0.0 0
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219191 85091415 1 NSiF3O9C35H40 ABC3D9E35F40 -556.91 3.8 -9.03 -1.75 0
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219192 85091423 1 ClN3O3F6H34C36 AB3C3D6E34F36 -338.66 4.31 -9.19 -0.81 0
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219193 85091426 1 O21C27H46 A21B27C46 -948.44 2.76 -9.95 0.26 0
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219194 85091428 1 F3O12C34H49 A3B12C34D49 -713.47 7.6 -10.22 0.7 0
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219195 85091431 1 SSiO6C42H46 ABC6D42E46 -166.56 5.43 -8.63 -0.09 0
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219196 85091448 1 Cl2N3O3F6C33H41 A2B3C3D6E33F41 -410.54 2.83 -8.68 -1.3 0
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219197 85091450 3 ClNO2C12H12 ABC2D12E12 -166.21 3.83 -8.83 -0.52 0
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219198 85091495 1 S2Si2O4C41H50 A2B2C4D41E50 -129.49 6.65 -8.5 -0.42 0
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219199 85091502 1 NO9C41H77 AB9C41D77 -513.05 4.95 -9.67 0.39 0
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219200 85091506 1 N2O8C43H56 A2B8C43D56 -282.89 9.12 -8.4 -1.5 0
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219201 85091525 1 N8O9C36H46 A8B9C36D46 -344.17 4.95 -8.75 -0.33 0
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219202 85091526 2 N2O4C21H23 A2B4C21D23 -224.9 5.02 -7.68 -1.58 0
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219203 85091556 1 N5O11C37H53 A5B11C37D53 -493.38 5.02 -9.59 -0.1 0
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219204 85091569 1 O6N7C41H61 A6B7C41D61 -307.14 9.71 -9.37 0.02 2
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219205 85091585 2 NOC16H28 ABC16D28 -4.29 1.92 -1.9 -0.72 0
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219206 85091586 1 O18C35H46 A18B35C46 -743.81 5.07 -8.74 -1.04 0
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219207 85091589 1 SN5O8C40H45 AB5C8D40E45 -244.01 8.96 -9.53 -0.94 0
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219208 85091597 2 NO4C23H24 AB4C23D24 -261.49 2.97 -8.14 -0.5 1
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219209 85091650 1 ClSN3O3C41H49 ABC3D3E41F49 -68.32 4.36 0.0 0.0 0
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219210 85091680 1 SO9N10C34H64 AB9C10D34E64 -472.51 10.51 -8.46 -0.15 0
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219211 85091709 1 N9O12C35H61 A9B12C35D61 -597.98 12.96 -9.46 -0.56 0
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219212 85091711 1 ClSN3O11C39H46 ABC3D11E39F46 -416.36 10.13 -7.78 -1.0 0
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219213 85091713 1 O19C38H40 A19B38C40 -705.23 9.11 -9.21 -1.19 0
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219214 85091714 4 O5C9H12 A5B9C12 -812.5 8.53 -8.7 -1.4 0
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219215 85096544 1 NO5C27H43 AB5C27D43 -253.76 4.11 -8.57 0.13 0
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219216 85096569 1 O11C22H24 A11B22C24 -421.76 4.08 -8.49 -0.9 0
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219217 85096570 1 LiSN6O7C17H25 ABC6D7E17F25 -276.25 10.11 -8.56 -0.86 0
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219218 85096576 1 O9C24H32 A9B24C32 -361.52 4.14 -9.57 0.2 0
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219219 85096578 1 PO6C25H37 AB6C25D37 -306.62 0.89 -8.79 0.35 0
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219220 85096579 1 SN2O7C22H28 AB2C7D22E28 -268.1 5.1 -8.61 -0.48 0
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219221 85096584 1 SiN2O5C25H30 AB2C5D25E30 -203.78 3.14 -9.26 -0.13 0
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219222 85096587 1 SiO3C29H40 AB3C29D40 -145.73 3.08 -8.92 0.19 0
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219223 85096588 1 Si2O4C25H44 A2B4C25D44 -259.18 2.65 -8.82 0.21 0
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219224 85096596 1 NSO8C22H27 ABC8D22E27 -266.75 7.91 -8.45 -0.37 0
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219225 85096610 1 PN2O5C25H27 AB2C5D25E27 -187.68 3.56 -8.94 -0.11 0
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219226 85096614 1 O5H26C30 A5B26C30 -82.65 1.87 -8.47 -0.51 0
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219227 85096615 2 NO3C13H15 AB3C13D15 -177.93 3.24 -8.27 -0.06 0
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219228 85096616 1 N4O7C22H34 A4B7C22D34 -324.39 4.84 -9.05 -0.22 0
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219229 85096618 1 O8C25H38 A8B25C38 -397.85 3.56 -9.79 0.2 0
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219230 85096625 1 ClSO4N6C19H23 ABC4D6E19F23 -99.22 2.75 -9.2 -1.16 0
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219231 85096643 1 O5C29H40 A5B29C40 -150.62 5.07 -8.59 0.22 1
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219232 85096645 1 PO2C30H46 AB2C30D46 -108.0 15.18 0.0 0.0 0
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219233 85096646 1 O3C31H48 A3B31C48 -126.66 4.23 -8.18 0.16 0
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219234 85096649 2 OC16H26 AB16C26 -150.13 1.44 -8.42 0.86 0
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219235 85096651 1 Si2O3C27H40 A2B3C27D40 -182.55 2.52 -8.61 0.18 0
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219236 85096667 1 SN2O4C27H30 AB2C4D27E30 -143.27 4.17 -8.54 -0.75 0
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219237 85096671 1 O3C31H50 A3B31C50 -199.85 7.83 -9.24 0.08 0
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219238 85096673 1 BrN2O5H19C22 AB2C5D19E22 -27.34 4.04 -9.31 -1.49 0