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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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45184 10508865 1 F3N6O7H33C34 A3B6C7D33E34 -362.72 11.15 -9.24 -1.7 0
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45185 10508874 1 S2O9C36H54 A2B9C36D54 -409.38 0.59 -9.13 -1.5 0
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45186 10508896 1 NPF2O7C38H46 ABC2D7E38F46 -338.98 2.58 -9.04 -0.14 0
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45187 10508967 2 O3C23H29 A3B23C29 -182.2 2.41 -9.22 0.12 0
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45188 10508991 1 N4O7C40H60 A4B7C40D60 -341.97 6.57 -9.64 -0.3 0
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45189 10508998 1 IO9C32H55 AB9C32D55 -378.6 1.52 -8.89 -1.2 1
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45190 10509005 1 NOPH29C33 ABCD29E33 84.35 6.15 0.0 0.0 0
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45191 10509006 1 SiO6C43H70 AB6C43D70 -335.07 3.28 -8.37 0.32 0
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45192 10509011 1 SO3N5H10F17C19 AB3C5D10E17F19 -876.79 2.12 -9.62 -1.38 0
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45193 10509029 1 N5O8C39H47 A5B8C39D47 -325.25 7.09 -8.96 -0.5 0
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45194 10509030 1 S2N3H31C48 A2B3C31D48 335.48 4.02 -7.76 -1.72 0
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45195 10509048 1 ON3H45C51 AB3C45D51 183.46 5.73 -8.8 -0.3 0
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45196 10509079 1 NSiS2F3O6C35H40 ABC2D3E6F35G40 -379.06 7.57 -8.86 -1.6 0
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45197 10509105 4 N2O2C9H13 A2B2C9D13 -351.58 6.05 -8.82 -0.05 0
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45198 10509133 2 O7C19H24 A7B19C24 -574.06 10.05 -9.65 -0.42 1
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45199 10509182 1 PSN6O6C37H46 ABC6D6E37F46 -45.51 4.74 0.0 0.0 0
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45200 10509221 2 ON2F3H17C21 AB2C3D17E21 -283.22 10.15 -8.35 -0.92 0
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45201 10509253 2 N3O5C19H23 A3B5C19D23 -410.75 8.1 -9.01 -0.72 0
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45202 10509278 1 O9H42C47 A9B42C47 -182.49 7.84 -8.69 -1.15 0
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45203 10509292 1 N7O9C38H55 A7B9C38D55 -417.45 10.08 -8.89 -0.24 0
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45204 10509303 1 N9O9C37H41 A9B9C37D41 -211.65 11.01 -9.41 -0.89 0
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45205 10509311 1 O14C39H64 A14B39C64 -680.83 6.53 -9.79 0.14 0
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45206 10509319 1 SN5O7C40H63 AB5C7D40E63 -302.4 5.96 -9.03 -0.25 0
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45207 10509378 2 N2F3H14C21 A2B3C14D21 35.69 4.2 -8.66 -2.33 1
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45208 10509398 1 NPO7C44H85 ABC7D44E85 -386.33 1.69 0.0 0.0 0
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45209 10509434 1 O7C48H86 A7B48C86 -271.37 4.05 -8.48 0.37 0
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45210 10509451 1 SeSiO5C44H64 ABC5D44E64 -245.61 6.5 -8.55 -0.27 0
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45211 10509499 1 N8O9C40H54 A8B9C40D54 -370.29 3.2 -8.79 0.08 0
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45212 10509525 1 N2F5O12H35C37 A2B5C12D35E37 -655.18 6.36 -9.49 -1.14 0
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45213 10509540 1 O3N7C50H51 A3B7C50D51 90.92 5.86 -8.9 -0.73 0
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45214 10509563 2 ClN3O3C21H23 AB3C3D21E23 -166.27 9.62 -8.2 -1.54 0
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45215 10509598 1 N5O9C45H53 A5B9C45D53 -185.83 1.61 -9.13 -0.4 0
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45216 10509621 1 N7O10C41H61 A7B10C41D61 -466.98 7.64 -9.26 -0.14 0
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45217 10509626 1 K4S4O16H20C21 A4B4C16D20E21 -926.21 25.9 -7.61 -0.31 0
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45218 10509629 1 BrSi2N4O8C36H61 AB2C4D8E36F61 -456.32 2.03 -8.75 -0.99 0
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45219 10509633 1 IO6F17H18C21 AB6C17D18E21 -1104.43 4.77 -10.27 -1.7 0
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45220 10509637 1 PN4O10C43H53 AB4C10D43E53 -380.07 10.4 -8.93 -0.56 0
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45221 10509638 1 O14C45H52 A14B45C52 -529.99 10.99 -8.94 -0.64 0
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45222 10509661 1 NO15C42H63 AB15C42D63 -681.46 9.67 -9.56 -0.23 2
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45224 10509689 12 OC4H5 AB4C5 -422.96 4.45 -9.03 -0.73 0
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45226 10509695 1 NO2H23C27 AB2C23D27 30.31 5.16 -8.34 -0.64 0
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45227 10509713 2 NH7C33 AB7C33 1374.83 14.95 -7.64 -2.17 0
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45228 10509717 1 SiF3N4O8C43H51 AB3C4D8E43F51 -486.17 5.62 -8.85 -1.26 0
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45229 10509727 1 SO11C48H56 AB11C48D56 -305.81 8.55 -9.34 -0.83 0
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45230 10509743 2 N2O2H25C28 A2B2C25D28 135.19 1.67 -7.76 -1.48 0
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45231 10509767 2 OC30H49 AB30C49 -207.07 3.16 -8.43 0.4 0
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45232 10509793 1 O17C43H70 A17B43C70 -810.96 1.85 -9.4 0.5 0
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45233 10509797 1 NH17C69 AB17C69 2127.49 2.6 -8.71 -3.04 0
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45234 10509814 1 SiN2O12C45H74 AB2C12D45E74 -656.73 5.29 -8.95 -0.5 0
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45235 10509827 1 ON11C53H59 AB11C53D59 181.72 2.2 -7.72 -1.12 0
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45236 10509848 1 NO15C46H63 AB15C46D63 -616.88 8.8 -8.84 -0.76 0
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45237 10509921 1 N5O5H53C57 A5B5C53D57 -8.17 9.74 -8.68 -0.47 0
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45238 10509936 1 SN9O18C33H51 AB9C18D33E51 -802.89 2.82 -9.51 -0.74 0
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45239 10509953 1 O18C45H70 A18B45C70 -762.05 6.58 -8.45 0.02 0
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45240 10509958 1 N2O11C52H70 A2B11C52D70 -502.3 8.76 -9.0 -1.04 0
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45241 10509962 1 N8O11C42H70 A8B11C42D70 -567.39 7.38 -9.34 0.02 0
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45242 10509987 2 O6H21C28 A6B21C28 -328.07 2.06 -8.63 -0.21 0
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45243 10510021 1 ClNSiSnO7C44H81 ABCDE7F44G81 -397.27 2.28 0.0 0.0 0
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45244 10510036 1 O15C49H92 A15B49C92 -825.39 5.4 -10.47 0.28 0
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45245 10510057 1 NO16C50H55 AB16C50D55 -523.25 5.67 -9.38 -0.52 0
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45246 10510073 1 PSiN4O11C49H55 ABC4D11E49F55 -388.77 6.13 -8.89 -1.09 0
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45247 10510083 1 Br2S2O5N6H34C43 A2B2C5D6E34F43 27.81 6.58 -8.44 -1.3 0
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45249 10510116 1 S2N3O16C44H59 A2B3C16D44E59 -619.7 7.35 -8.92 -2.15 0
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45250 10510117 1 NO11C56H87 AB11C56D87 -551.5 3.16 -9.74 -0.9 0
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45251 10510120 1 BrO4C60H87 AB4C60D87 -203.59 5.01 -8.54 -0.12 0
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45252 10510131 1 O17C50H84 A17B50C84 -898.93 2.66 -9.56 -0.4 0
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45253 10510133 1 N7O11H47C53 A7B11C47D53 -106.64 5.97 -8.53 -2.36 0
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45254 10510148 1 NH17C24F34 AB17C24D34 -1717.05 5.24 -9.23 -0.56 0
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45255 10510158 1 O19C49H78 A19B49C78 -920.29 3.14 -9.51 -0.01 0
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45256 10510211 1 N8O11C54H68 A8B11C54D68 -391.56 9.27 -9.23 -0.41 0
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45257 10510212 1 N8O14C49H80 A8B14C49D80 -551.07 3.35 -8.74 -0.37 2
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45258 10510220 4 NOC12H15 ABC12D15 -8.94 20.68 -3.56 -2.66 0
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45259 10510240 2 CoN4C30H36 AB4C30D36 163.2 26.99 -8.8 -6.61 1
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45260 10510261 1 FS2N7O7C47H47 AB2C7D7E47F47 -37.48 3.96 0.0 0.0 0
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45261 10510286 1 I2N8O10C39H52 A2B8C10D39E52 -408.31 9.68 -9.12 -1.24 0
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45262 10510305 1 PN6O15C53H65 AB6C15D53E65 -425.04 5.95 -8.84 -2.04 0
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45263 10510321 1 ClO9N14C52H67 AB9C14D52E67 -140.48 12.41 -8.73 -2.28 0
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45264 10510327 2 N5O5C29H36 A5B5C29D36 -334.67 8.93 -8.7 -0.26 0
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45265 10510335 1 S2O11N15C47H61 A2B11C15D47E61 -406.75 8.29 -8.77 -1.03 0
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45267 10510382 1 NSiO13C63H93 ABC13D63E93 -640.29 1.73 -9.01 0.11 0
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45268 10510390 2 NO3S8C18H18 AB3C8D18E18 -35.13 3.21 -7.64 -2.77 0
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45269 10510391 1 N5O21C51H87 A5B21C51D87 -1012.98 7.13 -9.29 -0.08 0
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45270 10510422 1 ClN2Si2O5C70H83 AB2C2D5E70F83 -198.48 5.53 -8.71 -0.69 0
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45271 10510425 1 P2O21C53H90 A2B21C53D90 -1114.08 4.96 -8.88 -0.09 0
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45272 10510435 1 N7O13C61H91 A7B13C61D91 -611.46 11.32 -8.61 -0.13 0
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45273 10510449 1 NSiO15C65H73 ABC15D65E73 -538.92 9.95 -8.99 -1.46 0
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45274 10510457 1 N5C76H95 A5B76C95 115.32 3.11 -7.49 -1.22 2
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45275 10510469 2 BrNH22C30 ABC22D30 303.6 17.75 -5.47 -2.07 0
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45276 10510478 1 IN4O13C57H81 AB4C13D57E81 -467.62 10.09 -8.51 -1.23 0
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45277 10510499 3 N2S2O6C15H24 A2B2C6D15E24 -863.39 2.12 -8.91 -1.33 0
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45278 10510524 2 INO3C31H38 ABC3D31E38 -218.78 8.09 -8.67 -0.83 0
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45279 10510531 1 ON6C84H98 AB6C84D98 148.52 10.41 -7.91 -1.64 0
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45280 10510532 1 SiN7O13C65H93 AB7C13D65E93 -529.58 10.18 -8.34 -0.39 0
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45281 10510537 2 O14C28H45 A14B28C45 -1303.05 3.76 -8.36 -0.33 0
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45282 10510544 1 ZnN8C80H80 AB8C80D80 700.28 9.33 -8.17 -1.79 0
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45283 10510550 1 O26C59H96 A26B59C96 -1264.36 6.58 -9.66 0.25 0
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45284 10510565 1 O26C61H86 A26B61C86 -1002.67 12.92 -8.14 -0.43 0
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45285 10510574 2 NCl3O5C32H41 AB3C5D32E41 -498.65 3.11 -8.07 -1.26 0
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45286 10510587 1 BrN8O13C65H79 AB8C13D65E79 -501.53 7.97 -9.15 -0.59 0
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45287 10510596 1 N8O15C68H104 A8B15C68D104 -806.03 5.52 -9.37 0.01 0