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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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54130 14720336 1 SN2O2C14H16 AB2C2D14E16 -34.9 5.58 -9.14 -0.14 0
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54131 14720337 1 O2N3H11C12 A2B3C11D12 49.05 8.79 -9.15 -0.96 0
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54132 14720341 1 SN2O2C13H14 AB2C2D13E14 -25.02 4.23 -9.14 -0.27 0
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54133 14720342 2 NOC7H8 ABC7D8 -20.77 3.73 -8.41 -0.04 0
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54134 14720346 1 SN2O2C15H18 AB2C2D15E18 -42.81 6.65 -9.09 -0.18 0
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54135 14720359 1 OSCl2N2F4H6C14 ABC2D2E4F6G14 -177.2 6.69 -9.17 -1.4 0
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54136 14720365 1 SiN4O7C26H56 AB4C7D26E56 -444.69 7.46 -8.92 0.56 0
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54137 14720378 1 NO4C15H17 AB4C15D17 -136.99 4.75 -9.77 -0.47 0
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54138 14720379 1 NO4C15H19 AB4C15D19 -160.09 5.18 -9.61 -0.29 0
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54139 14720380 1 NO4C15H19 AB4C15D19 -160.41 6.81 -9.63 -0.27 0
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54140 14720381 1 NO4C15H19 AB4C15D19 -160.4 3.95 -9.67 -0.27 0
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54141 14720388 1 N3O4C20H27 A3B4C20D27 -172.3 2.26 -8.7 -0.47 0
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54142 14720390 1 N3O4C20H27 A3B4C20D27 -160.22 8.28 -8.95 -0.44 0
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54143 14720391 1 N3O4C26H35 A3B4C26D35 -180.39 2.44 -8.83 -0.47 0
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54144 14720393 1 SN5C9H19 AB5C9D19 24.06 1.25 -8.67 -0.12 0
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54145 14720394 1 SN3O8C12H17 AB3C8D12E17 -355.43 10.59 -10.53 -1.3 0
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54146 14720396 1 SN3O3C20H25 AB3C3D20E25 -104.8 4.77 -9.33 -0.67 0
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54147 14720397 1 SN2O6C18H28 AB2C6D18E28 -267.91 7.86 -9.94 -0.6 0
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54148 14720399 1 SN5O10C42H57 AB5C10D42E57 -413.25 8.37 -9.57 -0.54 0
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54149 14720400 1 SN5O10C42H57 AB5C10D42E57 -335.05 6.45 -8.65 -0.91 0
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54150 14720401 1 SN5O9C41H57 AB5C9D41E57 -387.58 6.91 -9.4 -0.58 0
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54151 14720402 1 SN5O9C41H57 AB5C9D41E57 -378.11 4.35 -9.28 -0.37 0
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54152 14720409 1 ClSN5O7C30H44 ABC5D7E30F44 -301.42 5.97 -9.65 -0.44 0
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54153 14720410 1 SN5O7C30H43 AB5C7D30E43 -274.69 5.06 -8.84 -0.54 0
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54154 14720411 1 SN5O6C30H43 AB5C6D30E43 -240.67 2.95 -9.63 -0.53 0
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54155 14724606 1 SO13N14C59H80 AB13C14D59E80 -493.02 6.4 -8.88 -0.89 0
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54156 14728533 1 SO4H18C20 AB4C18D20 -74.41 7.45 -8.74 -0.8 0
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54157 14728810 1 NO4C25H33 AB4C25D33 -124.45 5.24 -8.51 0.21 0
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54158 14728866 1 N2O3C13H26 A2B3C13D26 -176.4 4.84 -9.57 0.66 0
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54159 14729672 1 NO17C27H39 AB17C27D39 -771.14 5.97 -10.04 0.29 0
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54160 14730449 1 N5O6C13H15 A5B6C13D15 -132.52 5.86 -10.06 -1.24 0
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54161 14730484 1 PN5O10C28H38 AB5C10D28E38 -474.03 4.88 -9.57 -0.22 0
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54162 14730560 1 SN6O6C33H34 AB6C6D33E34 -106.99 14.01 -8.57 -1.34 0
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54163 14732913 1 N2O2C13H20 A2B2C13D20 -73.35 3.35 -9.35 0.26 0
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54164 14733174 1 OC12H16 AB12C16 -26.17 1.63 -9.32 0.42 0
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54165 14735501 1 ClNO2C18H28 ABC2D18E28 -111.56 3.67 -10.41 -0.2 0
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54166 14735567 2 BrC4H6 AB4C6 9.48 2.55 -10.21 -0.57 0
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54167 14741441 1 O3N5H21C24 A3B5C21D24 1.57 7.78 -8.42 -1.29 0
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54168 14742044 1 SiO2C9H20 AB2C9D20 -180.8 2.71 -9.31 1.1 0
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54169 14742085 1 PO4C5F5H6 AB4C5D5E6 -465.83 3.39 -10.88 -0.87 0
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54170 14742178 1 NO5C15H21 AB5C15D21 -159.83 3.89 -9.16 -0.39 0
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54171 14742234 1 SO3C12H16 AB3C12D16 -134.5 1.87 -8.54 -0.64 0
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54172 14742608 1 ON4C7H12 AB4C7D12 20.52 2.52 -9.37 -0.44 0
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54173 14742700 1 NO3C21H21 AB3C21D21 -69.27 5.59 -8.89 -0.81 0
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54174 14742762 1 O3C16H18 A3B16C18 -109.65 4.13 -8.64 -0.76 0
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54175 14742771 1 O5C17H24 A5B17C24 -202.46 3.82 -9.1 -0.05 0
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54176 14743087 1 BrON2H21C24 ABC2D21E24 89.16 4.01 -9.18 -0.44 0
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54177 14743456 1 NO5C25H27 AB5C25D27 -106.11 3.9 -8.26 -0.04 0
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54178 14743457 1 NO9C27H29 AB9C27D29 -267.6 1.43 -8.74 -1.43 0
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54179 14743551 2 C27H46 A27B46 -137.25 1.03 -8.6 1.35 0
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54180 14745117 1 BrON2H25C28 ABC2D25E28 86.72 4.53 -7.91 -0.72 0
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54181 14745540 1 NO3C11H17 AB3C11D17 -139.62 4.15 -9.47 0.06 0
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54182 14746265 1 Cl4O7H12C24 A4B7C12D24 -227.96 7.03 -9.45 -1.7 0
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54183 14746360 1 OC16H16 AB16C16 37.5 2.8 -8.43 -0.6 0
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54184 14747239 2 SO4C17H27 AB4C17D27 -365.95 1.67 -9.51 -0.61 0
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54185 14747240 1 S2O8C35H40 A2B8C35D40 -257.21 7.93 -8.99 -0.35 0
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54186 14747241 1 S2O8C41H52 A2B8C41D52 -304.04 4.46 -8.53 -0.58 0
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54187 14747243 2 O2C14H17 A2B14C17 -122.84 1.12 -8.64 -0.29 0
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54188 14747246 4 OC9H14 AB9C14 -194.81 0.89 -9.19 0.39 0
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54189 14747249 1 CCoOSN2 ABCDE2 9.97 1.62 0.0 0.0 0
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54190 15047256 2 NO2S2H7C10 AB2C2D7E10 -38.54 0.3 -8.72 -2.29 0
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54191 15047275 1 NOC12H13 ABC12D13 -7.55 2.63 -8.77 -0.01 0
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54192 15047278 1 NOC13H15 ABC13D15 -12.32 2.59 -8.73 0.01 0
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54193 15047282 1 NOH15C16 ABC15D16 32.53 3.17 -9.48 -1.17 0
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54194 15047290 1 NOC17H19 ABC17D19 7.13 1.85 -8.86 -0.37 0
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54195 15047302 1 K2N3O4H5C7 A2B3C4D5E7 -241.27 10.57 -7.95 0.12 0
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54196 15047316 1 N4O4H14C17 A4B4C14D17 83.8 4.77 -9.18 -1.7 0
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54197 15047319 1 N2C19H20 A2B19C20 78.99 3.86 -8.01 -0.55 0
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54198 15047320 1 N2C21H24 A2B21C24 72.92 2.67 -8.12 -0.34 0
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54199 15047322 1 N2O2C19H20 A2B2C19D20 21.32 3.43 -7.8 -0.5 0
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54200 15047324 1 N2H20C25 A2B20C25 132.1 3.85 -8.15 -0.86 0
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54201 15047331 1 NCl2H9C11 AB2C9D11 32.47 2.64 -8.73 -0.59 1
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54202 15047345 1 NH14C17 AB14C17 83.21 0.68 0.0 0.0 0
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54203 15047357 1 INOC13H14 ABCD13E14 30.24 11.14 -7.4 -1.65 0
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54204 15047360 1 INC12H12 ABC12D12 56.95 5.04 -8.02 -0.8 0