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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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219239 85096674 1 SN3O3F6C18H19 AB3C3D6E18F19 -378.38 4.04 -9.05 -2.05 0
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219240 85096681 1 SN3O4C25H33 AB3C4D25E33 -157.27 4.85 -8.96 -0.29 0
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219241 85096686 1 N6O7C21H24 A6B7C21D24 -237.72 8.57 -9.47 -0.96 0
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219242 85096687 1 FO3N6C25H25 AB3C6D25E25 -51.81 4.59 -8.85 -1.66 0
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219243 85096688 1 O7H24C28 A7B24C28 -191.12 8.56 -9.03 -0.46 0
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219244 85096689 1 ClBr2O4H9C17 AB2C4D9E17 -79.5 6.59 -9.01 -1.82 0
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219245 85096693 1 O3N8C23H36 A3B8C23D36 -113.42 6.07 -8.66 -0.22 0
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219246 85096694 2 NO2C14H22 AB2C14D22 -237.1 4.87 -9.25 -0.12 0
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219247 85096695 2 NO2C14H22 AB2C14D22 -247.02 7.91 -9.14 -0.02 0
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219248 85096696 2 O2C15H24 A2B15C24 -214.54 3.52 -9.07 0.6 0
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219249 85096701 1 NBr2O4C18H19 AB2C4D18E19 -108.42 3.54 -8.93 -0.65 0
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219250 85096709 1 F3N4O4H21C23 A3B4C4D21E23 -239.25 13.43 -9.09 -1.44 0
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219251 85096711 1 O7H26C28 A7B26C28 -191.3 5.62 -8.5 -0.4 0
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219252 85096714 1 O2N6C27H34 A2B6C27D34 9.13 5.47 -8.77 -1.78 0
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219253 85096715 1 O4C31H38 A4B31C38 -110.77 5.99 -8.95 -0.3 0
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219254 85096721 1 BrClO2S2N5H13C15 ABC2D2E5F13G15 42.38 3.5 -8.35 -1.76 0
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219255 85096722 1 OSiSnC22H48 ABCD22E48 -151.39 1.16 -8.47 0.7 0
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219256 85096731 1 FSO2N5H22C25 ABC2D5E22F25 49.41 9.55 -9.02 -1.49 0
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219257 85096733 1 N3O4C28H33 A3B4C28D33 -106.86 6.24 -8.67 -0.59 0
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219258 85096745 1 O6C29H32 A6B29C32 -197.79 5.28 -9.33 -0.06 0
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219259 85096747 1 N2O4C29H36 A2B4C29D36 -137.42 4.23 -8.24 0.03 0
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219260 85096749 1 SiO6C26H40 AB6C26D40 -304.76 3.13 -9.71 -0.07 0
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219261 85098257 1 O8N9C30H41 A8B9C30D41 -320.46 12.08 -9.1 -0.9 1
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219262 85098277 1 NPO12C30H61 ABC12D30E61 -663.06 13.18 0.0 0.0 0
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219263 85098285 1 N7O10C30H41 A7B10C30D41 -403.09 4.61 -9.32 -0.59 0
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219264 85098313 1 O3N8C38H48 A3B8C38D48 -74.98 2.81 -8.6 -1.04 0
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219265 85098315 1 IN4O6C29H39 AB4C6D29E39 -223.43 8.0 -9.32 -1.47 0
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219266 85098322 1 INPO4C33H35 ABCD4E33F35 -113.42 14.06 -6.35 -0.91 0
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219267 85098325 1 F2N3O7C36H43 A2B3C7D36E43 -364.44 3.79 -8.96 -0.87 0
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219268 85098326 1 N7O8C33H45 A7B8C33D45 -283.87 5.96 -9.62 -0.95 0
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219269 85098328 1 O3N5C41H57 A3B5C41D57 -45.87 7.81 -8.1 -0.14 0
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219270 85098336 1 PS4O6C31H41 AB4C6D31E41 -223.28 6.59 -8.02 -1.21 0
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219271 85098340 1 N3S6O7H23C25 A3B6C7D23E25 -184.29 3.45 -8.99 -1.79 0
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219272 85098341 1 SN5O5C36H55 AB5C5D36E55 -239.16 4.04 -8.82 -0.29 0
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219273 85098342 1 S2N6O7C31H38 A2B6C7D31E38 -186.73 11.36 -9.02 -0.89 0
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219274 85098343 1 N2O10C35H62 A2B10C35D62 -494.83 3.74 -8.75 0.57 0
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219275 85098360 1 S2N5O7C33H35 A2B5C7D33E35 -136.19 4.63 -8.86 -0.88 1
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219276 85098395 1 SN4O6C38H45 AB4C6D38E45 -177.68 5.83 0.0 0.0 0
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219277 85098399 1 IS3N5O5C23H36 AB3C5D5E23F36 -173.95 30.35 -6.84 -1.35 0
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219278 85098413 1 SN4O8C36H40 AB4C8D36E40 -242.4 4.05 -8.84 -1.23 0
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219279 85098427 1 N8O9C32H54 A8B9C32D54 -396.38 17.6 -9.17 -0.63 0
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219280 85098428 1 SF3N3O6C36H36 AB3C3D6E36F36 -326.46 6.07 -9.49 -0.86 0
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219281 85098430 1 ClNO14C32H38 ABC14D32E38 -478.86 33.39 -7.66 -3.19 0
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219282 85098431 1 ISiN2O6C32H35 ABC2D6E32F35 -223.45 6.58 -9.01 -1.79 0
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219283 85098448 1 SF3N5O9C30H38 AB3C5D9E30F38 -508.62 5.32 -9.14 -0.67 0
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219284 85098457 1 F3O7C40H53 A3B7C40D53 -361.78 2.41 -9.36 -0.42 0
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219285 85098458 2 SO4C19H27 AB4C19D27 -221.81 5.21 -8.57 -0.29 0
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219286 85098459 1 ClSN6O10C29H43 ABC6D10E29F43 -438.62 5.09 -9.5 -1.28 0
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219287 85098467 1 ClF3O3N8C34H44 AB3C3D8E34F44 -268.97 2.94 -8.62 -0.82 0
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219288 85098489 1 Cl3N3O5C37H38 A3B3C5D37E38 -133.18 2.71 -9.18 -1.0 0