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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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63126 26744318 1 O4N5H20C21 A4B5C20D21 56.72 7.75 0.0 0.0 0
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63127 26744319 1 O4N5H19C21 A4B5C19D21 45.6 4.02 -8.47 -1.62 0
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63128 26744323 1 N5O6H17C19 A5B6C17D19 23.33 9.4 -9.95 -1.77 0
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63129 26744341 1 N4O7C22H24 A4B7C22D24 -85.1 5.23 -8.85 -1.51 1
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63130 26744342 1 N4O4C15H19 A4B4C15D19 -1.89 6.76 0.0 0.0 0
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63131 26744343 1 N4O4C15H18 A4B4C15D18 -9.5 6.46 -9.39 -1.61 1
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63132 26744346 1 O4N5C22H22 A4B5C22D22 54.4 6.77 0.0 0.0 0
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63133 26744351 2 O2N3C8H8 A2B3C8D8 37.16 7.78 -9.52 -1.48 0
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63134 26744363 4 NOC3H3 ABC3D3 1.78 4.05 -10.09 -1.56 1
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63135 26744364 1 FN3O3H23C24 AB3C3D23E24 -27.25 4.1 0.0 0.0 1
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63136 26744370 1 FO2N3C19H19 AB2C3D19E19 -2.01 5.91 0.0 0.0 1
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63137 26744372 1 N3O3F4H18C20 A3B3C4D18E20 -206.28 6.07 0.0 0.0 0
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63138 26744373 1 N3O3F4H17C20 A3B3C4D17E20 -220.31 3.57 -9.56 -1.07 1
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63139 26744376 1 FO2N4H18C20 AB2C4D18E20 34.01 6.68 0.0 0.0 1
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63140 26744378 1 FO2N3C19H25 AB2C3D19E25 -52.92 5.85 0.0 0.0 2
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63141 26744390 1 FO2N4C18H25 AB2C4D18E25 -39.68 12.02 -7.22 -0.4 1
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63142 26744394 1 FO2N4C18H18 AB2C4D18E18 7.27 5.87 0.0 0.0 1
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63143 26744396 1 FO2N4C18H18 AB2C4D18E18 7.93 5.79 0.0 0.0 1
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63144 26744404 1 FSO2N3C17H17 ABC2D3E17F17 3.22 5.61 0.0 0.0 0
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63145 26744407 1 FO2N3C20H20 AB2C3D20E20 -25.11 3.03 -9.1 -0.68 0
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63146 26744409 1 FN3O5C22H24 AB3C5D22E24 -133.87 5.79 -9.16 -0.69 0
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63147 26744411 1 FO2N3C15H18 AB2C3D15E18 -53.9 2.37 -9.24 -0.94 0
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63148 26744413 1 FO3N4C21H21 AB3C4D21E21 -71.66 3.72 -8.87 -0.97 1
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63149 26744414 1 FN4O4H18C19 AB4C4D18E19 -29.28 6.47 0.0 0.0 1
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63150 26744416 1 FN3O3H19C21 AB3C3D19E21 -17.36 5.28 0.0 0.0 0
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63151 26744419 1 FO2N5C16H16 AB2C5D16E16 -7.15 4.24 -9.37 -0.83 0
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63152 26744421 1 FO2N3C16H18 AB2C3D16E18 -26.92 2.25 -9.37 -0.99 1
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63153 26744424 1 FO2N5C21H21 AB2C5D21E21 26.55 4.86 0.0 0.0 0
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63154 26744431 1 N4O5C20H24 A4B5C20D24 -112.16 4.53 -9.08 -1.09 0
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63155 26744433 1 N3O5C21H21 A3B5C21D21 -71.71 3.41 -8.78 -0.77 0
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63156 26746536 2 NO3C9H10 AB3C9D10 -179.89 2.56 -9.12 -0.89 0
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63157 26746537 1 N2F3O4C15H15 A2B3C4D15E15 -316.25 2.21 -9.44 -1.12 0
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63158 26746541 1 N2O6C23H24 A2B6C23D24 -137.07 1.12 -8.53 -0.83 0
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63159 26746547 1 NSF2O3C13H15 ABC2D3E13F15 -224.83 7.46 -9.17 -0.78 0
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63160 26746560 1 N2O7C22H22 A2B7C22D22 -164.0 6.14 -8.66 -0.7 0
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63161 26746561 1 NO4C14H19 AB4C14D19 -168.6 3.73 -8.35 0.02 0
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63162 26746562 1 SN3O6C25H27 AB3C6D25E27 -150.49 3.28 -9.07 -0.84 0
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63163 26746564 1 SN3O7C24H25 AB3C7D24E25 -172.17 5.37 -9.24 -1.02 0
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63164 26746565 1 NO4C13H17 AB4C13D17 -161.91 6.44 -8.39 0.0 0
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63165 26746566 1 NO4C13H17 AB4C13D17 -161.97 3.4 -8.4 -0.01 0
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63166 26746567 1 SN3O7C24H25 AB3C7D24E25 -178.82 3.64 -9.14 -1.01 0
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63167 26746568 1 ClNO3C13H16 ABC3D13E16 -140.6 4.31 -9.05 -0.31 0
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63168 26746569 1 ClNO3C13H16 ABC3D13E16 -140.57 4.18 -9.06 -0.31 0
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63169 26746570 1 ClSN2O5C14H19 ABC2D5E14F19 -202.56 6.56 -9.16 -0.82 0
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63170 26746571 1 N3O5H17C22 A3B5C17D22 -77.35 3.6 -9.18 -1.38 0
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63171 26746572 1 ClSN2O5C14H19 ABC2D5E14F19 -201.87 8.55 -9.18 -0.88 0
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63172 26746573 1 SN3O5H19C22 AB3C5D19E22 -94.35 3.19 -8.93 -0.88 0
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63173 26746574 1 ClFNO3C12H13 ABCD3E12F13 -174.35 4.84 -9.08 -0.56 0
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63174 26746575 1 ClFNO3C12H13 ABCD3E12F13 -176.93 3.83 -9.15 -0.68 0
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63175 26746576 1 SN3O5H19C22 AB3C5D19E22 -94.98 3.3 -8.9 -0.86 0
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63176 26746577 1 NO4C14H19 AB4C14D19 -169.47 3.25 -8.3 0.0 0
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63177 26746579 1 NO4C14H19 AB4C14D19 -169.95 4.9 -8.42 -0.01 0
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63178 26746580 1 ClN2O3C11H13 AB2C3D11E13 -117.16 4.33 -9.21 -0.7 0
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63179 26746616 1 N3O6C23H23 A3B6C23D23 -143.32 1.87 -9.11 -0.64 0
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63180 26746618 1 ClN2O3C13H13 AB2C3D13E13 -99.34 8.44 -9.56 -1.07 0
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63181 26746619 1 N3O6C25H25 A3B6C25D25 -127.18 4.21 -8.97 -0.76 0
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63182 26746620 1 ClN2O3C13H13 AB2C3D13E13 -101.02 9.09 -9.46 -1.0 0
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63183 26746621 1 N3O5H21C22 A3B5C21D22 -96.91 5.15 -9.09 -0.85 0
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63184 26746622 1 N3O6C25H25 A3B6C25D25 -140.33 5.8 -8.27 -0.97 0
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63185 26746624 1 N3O6C25H25 A3B6C25D25 -138.82 6.81 -8.23 -0.96 0
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63186 26746625 2 NO2C7H9 AB2C7D9 -170.1 3.95 -9.56 -0.2 0
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63187 26746626 1 N2O4C11H20 A2B4C11D20 -213.57 5.64 -10.29 0.02 0
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63188 26746628 1 N2O4C11H20 A2B4C11D20 -220.67 0.93 -10.03 0.07 0
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63189 26746630 1 N2O6C15H18 A2B6C15D18 -240.53 3.09 -8.36 -0.42 0
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63190 26746631 1 N2O5H20C24 A2B5C20D24 -65.97 2.28 -8.61 -0.96 0
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63191 26746634 2 NO2C6H10 AB2C6D10 -209.73 1.94 -10.02 0.04 0
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63192 26746638 1 O4N5C17H19 A4B5C17D19 -92.64 2.03 -8.71 -1.11 0
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63193 26746640 1 N3O5H19C21 A3B5C19D21 -99.82 2.76 -9.12 -0.9 0
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63194 26746641 1 N2O6C17H18 A2B6C17D18 -212.78 1.91 -8.89 -1.45 0
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63195 26746642 1 S2N3O6C22H23 A2B3C6D22E23 -125.42 5.92 -9.07 -0.88 0
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63196 26746648 1 ClSN2O4H19C21 ABC2D4E19F21 -60.62 3.42 -8.99 -0.84 0
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63197 26746649 1 ClNO5C15H16 ABC5D15E16 -190.27 4.04 -9.12 -1.35 0
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63198 26746650 1 N2O6H20C21 A2B6C20D21 -123.77 3.78 -8.63 -0.88 0
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63199 26746651 1 ClNO5C15H16 ABC5D15E16 -186.27 2.14 -9.19 -1.35 0
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63200 26750101 1 SN3O7C18H21 AB3C7D18E21 -161.89 7.55 -9.63 -1.66 0