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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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7111 71239 1 NSO4C20H33 ABC4D20E33 -199.25 2.08 -9.1 0.06 0
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7112 71241 1 FN3O3C22H28 AB3C3D22E28 -120.65 5.09 -8.4 -0.13 0
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7113 71242 1 ON2C18H24 AB2C18D24 8.83 3.7 -9.32 -0.28 0
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7114 71247 1 I6N6O16C35H44 A6B6C16D35E44 -504.92 17.53 -7.78 -2.29 0
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7115 71250 1 O5H14C16 A5B14C16 -149.65 4.24 -8.84 -0.85 0
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7116 71253 1 SN4O4C17H26 AB4C4D17E26 -140.54 8.66 -9.0 -0.22 0
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7117 71263 1 N4C13H16 A4B13C16 61.68 3.67 -8.5 -0.36 0
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7118 71264 1 N3O3C21H25 A3B3C21D25 -86.36 3.8 -8.77 -0.08 0
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7119 71265 1 Cl2O3N4C15H18 A2B3C4D15E18 -79.47 4.53 -9.07 -0.77 0
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7120 71269 1 O3F6C27H38 A3B6C27D38 -476.71 2.5 -8.66 0.14 0
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7121 71272 1 BrClON2C18H18 ABCD2E18F18 23.06 2.46 -8.32 -0.39 0
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7122 71273 1 ON2C17H26 AB2C17D26 -57.16 4.09 -8.74 0.39 0
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7123 71291 1 NO2C12H17 AB2C12D17 -77.85 1.53 -9.07 -0.04 0
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7124 71305 1 ON3C15H15 AB3C15D15 2.92 1.19 -8.78 -1.19 0
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7125 71307 1 ClON3C8H10 ABC3D8E10 -16.35 1.55 -9.56 -1.15 0
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7126 71309 1 S3N5O7H17C19 A3B5C7D17E19 -120.15 5.51 -9.18 -1.0 0
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7127 71311 1 S3O5N6H18C19 A3B5C6D18E19 -36.39 2.43 -8.95 -1.14 0
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7128 71319 1 ClN2C18H21 AB2C18D21 43.66 2.47 -8.48 -0.27 0
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7129 71324 1 N2S2O5C21H24 A2B2C5D21E24 -168.35 4.57 -9.17 -0.47 0
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7130 71325 1 O3C27H40 A3B27C40 -121.24 2.98 -8.58 0.27 0
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7131 71326 1 SN3O11C42H55 AB3C11D42E55 -428.64 10.94 -8.18 -1.2 0
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7132 71329 1 S2N3O5C19H27 A2B3C5D19E27 -164.39 6.02 -8.42 0.0 0
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7133 71332 2 O7C25H37 A7B25C37 -620.91 3.49 -9.31 0.03 0
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7134 71333 1 Cl3N3H6C10 A3B3C6D10 70.94 2.47 -9.7 -1.08 0
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7135 71337 1 ClO5N6H39C41 AB5C6D39E41 -82.68 5.73 -7.97 -0.61 0
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7136 71347 1 SN3O5C24H27 AB3C5D24E27 -133.31 6.21 -8.74 -0.56 0
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7137 71348 1 S2N11O12C56H73 A2B11C12D56E73 -502.7 12.14 -8.85 -1.06 0
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7138 71349 1 S2O10N11C54H69 A2B10C11D54E69 -387.2 8.66 -8.51 -0.65 0
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7139 71350 1 SN2O3C23H28 AB2C3D23E28 -90.19 3.13 -9.03 -0.86 0
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7140 71351 1 FO2N4C24H25 AB2C4D24E25 -31.19 5.68 -8.62 -0.92 0
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7141 71352 1 ClNOC21H24 ABCD21E24 -17.81 6.65 -8.75 -0.56 0
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7142 71354 1 N2O3C19H20 A2B3C19D20 -55.64 6.16 -8.89 -0.46 0
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7143 71356 1 O2N5C13H17 A2B5C13D17 -18.93 4.16 -9.07 -0.57 0
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7144 71358 1 O3N4C17H22 A3B4C17D22 -8.25 5.1 -8.73 -0.82 0
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7146 71370 1 BrNC3H10 ABC3D10 -33.82 7.33 -9.39 1.16 0
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7147 71371 1 N2Na2I7O8H21C30 A2B2C7D8E21F30 -69.77 380.29 -5.39 -4.38 0
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7148 71375 1 KMgN3C12O12H18 ABC3D12E12F18 -678.44 12.39 -9.46 -0.75 0
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7149 71384 1 N4O4C11H16 A4B4C11D16 -169.95 1.08 -9.93 -0.51 0
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7150 71387 1 ClFO4C22H26 ABC4D22E26 -218.24 8.08 -9.86 -0.72 0
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7151 71388 1 O3C17H28 A3B17C28 -97.91 4.35 -8.66 0.33 0
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7152 71390 1 N5O9C34H63 A5B9C34D63 -526.22 9.83 -9.88 0.4 0
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7153 71393 1 ClNO2C17H24 ABC2D17E24 -89.34 2.24 -8.55 0.35 0
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7154 71409 1 BrNO3C12H18 ABC3D12E18 -140.27 1.35 -8.98 -0.34 0
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7155 71413 1 ClN2C22H31 AB2C22D31 -2.73 4.59 -8.01 0.44 0
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7156 71414 1 F2O7C26H32 A2B7C26D32 -395.34 4.01 -10.05 -0.92 0
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7157 71417 1 ClO2N3C15H24 AB2C3D15E24 -124.86 8.84 -9.25 -0.48 0
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7158 71421 1 ClN2O3C29H33 AB2C3D29E33 -33.16 3.24 -9.14 -0.41 0
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7159 71423 1 ClSO2N3H14C17 ABC2D3E14F17 -21.5 1.78 -8.65 -1.27 0
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7160 71424 1 ClNO3C13H20 ABC3D13E20 -132.18 2.33 -8.71 -0.01 0
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7161 71426 1 NO2C18H23 AB2C18D23 -56.84 5.71 -8.7 -0.26 0
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7162 71428 1 N5O11C21H41 A5B11C21D41 -496.46 5.27 -9.34 0.69 0
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7163 71436 1 NO8C24H45 AB8C24D45 -401.48 6.28 -9.95 0.38 0
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7164 71437 1 O5C22H38 A5B22C38 -266.42 1.43 -9.59 0.55 0
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7165 71441 1 ClON2C18H25 ABC2D18E25 -52.94 2.83 -8.57 -0.19 0
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7166 71443 1 AuSNa2C4H5O5 ABC2D4E5F5 -266.24 8.2 -8.08 -0.58 0
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7167 71448 2 NO3H8C9 AB3C8D9 -183.07 4.31 -9.29 -2.01 0
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7168 71449 1 S2N4O7C14H20 A2B4C7D14E20 -187.55 8.97 -9.21 -1.5 0
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7169 71453 2 N2O3C12H14 A2B3C12D14 -199.23 5.17 -9.3 -0.73 0
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7170 71465 1 ClNO3C13H22 ABC3D13E22 -167.36 1.82 -8.81 -0.12 0
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7171 71466 1 NO3C13H21 AB3C13D21 -136.99 1.24 -8.78 -0.14 0
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7172 71468 1 CaN6O6H16C18 AB6C6D16E18 -103.67 4.14 -9.44 -2.09 0
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7173 71470 1 FO7C29H39 AB7C29D39 -313.81 4.98 -8.87 -0.57 0
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7174 71471 1 ClNOC11H18 ABCD11E18 -63.49 2.49 -8.86 0.2 0
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7175 71472 1 NOC11H17 ABC11D17 -27.06 2.53 -8.66 0.44 0
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7176 71477 1 N6O10C25H27 A6B10C25D27 -144.38 6.99 0.0 0.0 -3
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7177 71478 1 ClNC20H24 ABC20D24 2.17 0.99 -9.06 0.37 0
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7178 71479 1 NO5C23H35 AB5C23D35 -208.44 3.39 -8.63 -1.48 0
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7179 71481 1 S2O5N8C33H48 A2B5C8D33E48 -166.05 3.23 -8.51 -1.28 0
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7180 71483 1 S2N4O8H16C21 A2B4C8D16E21 -69.53 6.73 -9.64 -2.21 0
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7181 71484 2 NaN2O2H16C17 AB2C2D16E17 -159.63 4.87 -8.57 -1.82 0
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7182 71485 1 Cl3O8C12H19 A3B8C12D19 -400.47 1.44 -10.53 -0.16 0
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7183 71486 1 ClNO5C19H30 ABC5D19E30 -265.26 5.62 -9.15 -0.49 0
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7184 71487 1 N3O5C14H23 A3B5C14D23 -205.4 6.0 -9.23 0.26 0
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7185 71489 1 BrON2C22H29 ABC2D22E29 -17.78 16.82 -7.54 -0.65 0
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7186 71490 1 ON2C22H29 AB2C22D29 20.31 3.4 0.0 0.0 1
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7187 71491 1 BrNO4C24H30 ABC4D24E30 -123.59 11.23 -7.86 -0.36 0
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7188 71492 1 NO4C24H30 AB4C24D30 -93.48 4.17 0.0 0.0 1
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7189 71493 1 BrOSN2C20H23 ABCD2E20F23 -3.33 7.55 -8.31 -0.35 0
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7190 71496 2 N2O2C9H20 A2B2C9D20 -77.68 1.62 -2.29 -1.44 2
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7191 71499 1 ClN3C24H24 AB3C24D24 71.04 0.76 -7.63 -0.56 0
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7192 71500 3 NC8H8 AB8C8 91.07 4.82 0.0 0.0 1
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7193 71501 1 SC4O4N6H16 AB4C4D6E16 -162.5 9.18 -9.77 -0.03 0
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7195 71504 1 NC22H40 AB22C40 -32.07 1.6 0.0 0.0 1
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7196 71505 1 N2Na2S3O18C24H34 A2B2C3D18E24F34 -860.72 15.54 -8.85 -0.63 0
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7197 71506 1 N2S3O18C24H36 A2B3C18D24E36 -737.2 8.9 -9.46 -0.83 0
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7200 71512 2 INOC6H13 ABCD6E13 -72.27 28.87 -6.18 -1.54 0
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7201 71513 2 NOC6H13 ABC6D13 -70.4 12.36 -8.14 0.02 2
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7202 71514 1 NSO3C19H25 ABC3D19E25 -89.43 10.89 -9.06 -0.45 0
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7203 71516 1 BrNO2C18H38 ABC2D18E38 -164.15 7.64 -8.85 0.42 0
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7204 71517 1 NO2C18H38 AB2C18D38 -130.21 4.62 0.0 0.0 1
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7205 71521 1 INO3C21H26 ABC3D21E26 -78.75 12.1 -7.41 -0.48 0
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7206 71523 1 ISO3C18H27 ABC3D18E27 -59.25 32.99 -4.82 -2.3 0
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7207 71531 1 BrNO3C23H26 ABC3D23E26 -88.47 13.24 -7.76 -0.68 0
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7208 71533 1 NSO5C19H27 ABC5D19E27 -157.57 15.42 -9.63 -0.65 0
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7209 71539 1 FeOC19H26 ABC19D26 133.45 5.02 -7.43 -1.1 0
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7210 71541 2 ClON3C23H25 ABC3D23E25 32.6 31.52 -7.53 -2.76 0
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7211 71542 1 N2O2C21H28 A2B2C21D28 -61.5 5.22 -8.66 -0.65 0
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7212 71543 2 ON5C17H39 AB5C17D39 -170.44 5.99 -8.57 1.0 0
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7213 71549 1 S2N4O9C18H26 A2B4C9D18E26 -323.55 8.67 -9.0 -0.4 0
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7214 71550 1 SN2O6C20H32 AB2C6D20E32 -226.12 4.98 -8.66 -0.99 0