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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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181223 76718121 1 O2N4H41C47 A2B4C41D47 103.37 5.34 0.0 0.0 0
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181224 76718401 1 NO2C14H27 AB2C14D27 -134.82 3.28 -9.02 1.44 0
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181225 76718456 1 O4N7C36H47 A4B7C36D47 -135.08 2.63 -8.57 -0.82 0
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181226 76718490 1 O4N6C41H44 A4B6C41D44 -74.46 4.43 -8.65 -0.52 0
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181228 76718610 1 Na2S2O9H28C38 A2B2C9D28E38 -139.19 60.36 -7.4 -3.12 0
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181229 76718806 1 BrON2H17C18 ABC2D17E18 7.68 4.45 -9.13 -0.88 0
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181230 76718807 1 ON3C20H23 AB3C20D23 8.89 3.15 -8.17 -0.47 0
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181231 76719060 1 N2O3C14H16 A2B3C14D16 -59.69 2.97 -10.36 -1.54 0
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181232 76719061 1 O2N3C17H17 A2B3C17D17 6.57 5.09 -9.75 -1.43 0
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181233 76719062 1 FN2O3C17H21 AB2C3D17E21 -120.12 3.59 -10.53 -1.76 1
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181234 76719063 1 O5N6C28H33 A5B6C28D33 -89.54 5.34 0.0 0.0 0
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181235 76719764 1 F2O2N3C22H23 A2B2C3D22E23 -103.44 4.55 -8.41 -0.96 0
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181236 76719765 1 ON6C31H38 AB6C31D38 65.39 3.01 -8.37 -0.58 0
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181237 76719766 1 F3O3N4C28H31 A3B3C4D28E31 -172.65 3.48 -8.1 -1.29 0
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181238 76719767 1 O3N4C27H32 A3B4C27D32 -4.07 1.33 -7.98 -0.71 0
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181239 76719818 2 N2C10H11 A2B10C11 66.22 3.41 -8.66 -0.23 0
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181240 76719966 1 N2O3C13H14 A2B3C13D14 -61.74 3.32 -8.86 -0.91 0
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181241 76720072 1 FO2N6C19H19 AB2C6D19E19 37.3 2.39 -8.94 -1.13 0
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181242 76720143 1 ClO2N5H24C31 AB2C5D24E31 69.1 1.95 -9.0 -1.28 0
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181243 76720721 1 PN6O11C29H51 AB6C11D29E51 -559.18 12.64 -8.89 -0.21 -1
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181244 76721117 1 ClRuO3N4H37C40 ABC3D4E37F40 382.64 2.94 -6.58 -3.47 0
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181245 76721500 1 BrON4C18H23 ABC4D18E23 5.45 4.44 -8.34 -0.52 0
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181246 76721501 1 BrON5C19H20 ABC5D19E20 47.6 5.39 -8.28 -1.13 0
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181247 76721502 1 BrON6C19H21 ABC6D19E21 32.25 5.91 -8.49 -1.03 0
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181248 76721503 1 BrON4C19H27 ABC4D19E27 -28.5 5.49 -8.18 -0.37 0