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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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233132 87692496 1 OCl3N3C20H22 AB3C3D20E22 19.02 0.28 -9.49 -1.0 0
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233133 87692501 1 AsSO5C6H15 ABC5D6E15 -209.07 3.55 -9.59 -0.08 0
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233134 87692514 1 F3N4O6H29C31 A3B4C6D29E31 -304.75 5.24 -8.56 -1.01 0
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233135 87692520 1 AsNSiTiC25H34 ABCDE25F34 285.93 2.4 -6.38 -2.19 0
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233136 87692529 1 BrFO2N6C21H28 ABC2D6E21F28 -103.44 3.37 -8.9 -0.9 0
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233137 87692543 1 AgNO2C8H16 ABC2D8E16 -95.93 4.14 -8.25 -5.24 0
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233138 87692546 1 OCl2N3C23H25 AB2C3D23E25 76.56 4.25 -8.91 -0.68 0
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233139 87692551 1 OF2C7H12 AB2C7D12 -157.6 0.64 -10.66 -0.61 0
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233140 87692555 1 ClFSN4O4C18H18 ABCD4E4F18G18 -86.14 8.41 -8.92 -1.05 0
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233141 87692559 1 O5C9H12 A5B9C12 -179.2 5.31 -10.45 -1.47 0
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233142 87692570 1 NO3C5H11 AB3C5D11 -143.27 4.81 -9.95 0.66 0
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233143 87692572 1 N2O3C7H18 A2B3C7D18 -141.28 2.93 -8.9 0.19 0
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233144 87692576 1 AsF2N2O5C24H33 AB2C2D5E24F33 -267.61 1.31 -9.25 -0.97 0
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233145 87692577 1 Cl2O2N3C28H29 A2B2C3D28E29 47.02 3.77 -8.98 -0.42 0
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233146 87692583 2 PC5H12 AB5C12 -65.62 2.66 -8.86 2.47 0
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233148 87692591 2 NSO2C5H12 ABC2D5E12 -186.53 0.37 -9.44 -0.14 1
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233150 87692595 1 O3C16H34 A3B16C34 -196.17 3.26 -9.72 1.38 0
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233151 87692610 1 KO2N3C17H17 AB2C3D17E17 39.78 15.41 0.0 0.0 0
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233152 87692612 1 ISCl2O4N6H25C28 ABC2D4E6F25G28 -10.27 12.84 -8.75 -1.56 0
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233155 87692652 1 NBr2O5H21C29 AB2C5D21E29 45.69 5.51 -9.36 -1.13 0
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233156 87692656 1 O2N6C25H26 A2B6C25D26 53.42 3.66 -8.26 -0.66 0
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233157 87692664 1 BN4O7C34H49 AB4C7D34E49 -258.34 2.42 -9.53 -0.96 0
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233158 87692666 1 IN4C29H29 AB4C29D29 147.0 3.97 -8.83 -1.72 0
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233159 87692669 1 AsN2O4H9C13 AB2C4D9E13 -73.35 5.18 -8.12 -1.84 0
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233160 87692691 1 N2O2C15H24 A2B2C15D24 -52.17 2.9 -8.38 -0.04 0
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233161 87692701 1 O5C20H34 A5B20C34 -235.67 8.88 -9.17 -1.18 0
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233162 87692705 1 ClNSO4C15H22 ABCD4E15F22 -187.45 6.45 -9.66 -0.38 0
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233163 87692707 1 FO2N3H24C27 AB2C3D24E27 6.15 3.55 -8.39 -0.73 0
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233164 87692740 1 O3C10H14 A3B10C14 -76.83 1.7 -10.29 -0.22 0
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233165 87692751 1 PO3C9H15 AB3C9D15 -135.88 3.09 -9.67 0.44 0
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233166 87692752 1 PO3C9H15 AB3C9D15 -149.13 3.22 -9.08 0.63 0
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233167 87692760 1 O2N3F6C17H21 A2B3C6D17E21 -386.94 8.46 -9.86 -0.76 1
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233168 87692768 1 PO6C7H16 AB6C7D16 -298.4 5.26 0.0 0.0 0
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233169 87692771 1 OC12H12 AB12C12 6.76 1.33 -8.63 -0.23 0
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233170 87692776 1 NO4C9H9 AB4C9D9 -90.99 3.01 -10.68 -1.58 0
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233171 87692782 1 FS2N4O8C41H43 AB2C4D8E41F43 -222.62 8.08 -8.58 -0.95 0
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233172 87692787 1 N3O3F6H23C25 A3B3C6D23E25 -361.53 4.25 -9.18 -1.61 0
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233173 87692793 1 BrF3N5O6C57H61 AB3C5D6E57F61 -256.94 11.09 -8.26 -0.76 0
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233174 87692799 1 OSN3C12H13 ABC3D12E13 8.18 0.73 -8.75 -1.18 0
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233175 87692808 1 NSO3H15C16 ABC3D15E16 -61.8 5.59 -8.77 -0.25 0
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233176 87692809 1 FO2N4C22H27 AB2C4D22E27 -96.47 4.65 -8.92 -1.22 0
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233177 87692812 1 ClSO2N5C21H30 ABC2D5E21F30 -52.63 8.15 -8.74 -0.88 0
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233178 87692854 1 S2O3N4C16H18 A2B3C4D16E18 -77.78 6.56 -9.31 -0.74 0
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233179 87692855 1 SN3F6H17C24 AB3C6D17E24 -190.68 8.49 -9.2 -1.33 0
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233180 87692858 1 N2O3C26H28 A2B3C26D28 -64.06 9.29 -8.57 -0.75 0
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233181 87692862 2 C2O2N3H6 A2B2C3D6 -90.01 1.56 -9.73 0.08 0
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233182 87692903 1 O9C63H104 A9B63C104 -466.13 7.47 -9.14 0.11 0
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233183 87692905 1 IOF3N4H12C14 ABC3D4E12F14 -110.36 5.1 -9.3 -1.73 0
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233184 87692907 1 O6C13H20 A6B13C20 -289.07 3.76 -10.42 0.47 0
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233185 87692919 1 OH28C48 AB28C48 174.86 1.57 -8.51 -0.83 0