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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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185145 77261927 1 SiN3O5C42H63 AB3C5D42E63 -264.93 4.78 -8.32 -0.58 0
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185146 77261928 1 ON4C11H14 AB4C11D14 2.56 1.65 -9.66 -0.79 0
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185147 77261929 1 ClNSO6C29H32 ABCD6E29F32 -223.3 4.06 -8.59 -0.57 0
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185148 77261982 1 BrON3C13H16 ABC3D13E16 -23.94 1.87 -10.06 -0.65 0
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185149 77261988 1 OF3N4C24H27 AB3C4D24E27 -126.76 6.49 -9.62 -0.35 0
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185150 77262064 1 F2O2N3C26H29 A2B2C3D26E29 -103.9 4.24 -9.8 -1.12 0
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185151 77262201 1 OF3N5C21H24 AB3C5D21E24 -104.6 6.24 -9.43 -0.67 0
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185152 77262227 1 NCl2O5C16H19 AB2C5D16E19 -174.01 4.97 -8.87 -1.61 0
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185153 77262570 1 FN3O6C24H30 AB3C6D24E30 -267.01 3.03 -9.35 -1.17 0
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185154 77262583 1 SN3O5C24H31 AB3C5D24E31 -178.29 3.23 -9.08 -1.3 0
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185155 77262722 1 N2O5C27H34 A2B5C27D34 -141.91 4.06 -8.13 -0.18 0
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185156 77262729 1 NOCl2C10H11 ABC2D10E11 -36.82 2.17 -8.99 -0.07 0
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185157 77263133 1 NO7C15H21 AB7C15D21 -271.26 1.92 -9.81 -1.18 0
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185158 77263134 1 FON4C25H27 ABC4D25E27 -20.04 4.74 -8.28 -0.47 0
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185159 77263409 1 SO3N4C28H42 AB3C4D28E42 -130.66 4.82 -8.71 -0.77 0
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185160 77263410 1 N3O3C13H17 A3B3C13D17 -111.05 5.05 -9.75 -0.22 0
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185161 77263494 1 F3O3N4C29H33 A3B3C4D29E33 -180.67 7.38 -8.26 -0.73 0
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185162 77263495 1 O2N8C27H30 A2B8C27D30 81.02 5.26 -8.72 -1.0 0
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185163 77263941 1 O4C29H34 A4B29C34 -126.59 3.29 -9.35 0.03 0
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185164 77263942 1 O3N6C21H32 A3B6C21D32 -86.21 7.22 -8.53 0.05 1
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185165 77263980 1 O3N8C19H29 A3B8C19D29 -44.88 5.39 0.0 0.0 1
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185166 77264166 1 O3N7C25H36 A3B7C25D36 -37.55 3.88 0.0 0.0 1
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185167 77264167 1 O4N6C18H27 A4B6C18D27 -94.08 2.91 0.0 0.0 0
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185168 77264897 1 FN3O6C15H22 AB3C6D15E22 -293.82 5.15 -9.83 -0.94 0
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185169 77265081 1 N2O3C19H24 A2B3C19D24 -101.6 5.69 -9.88 -0.43 0
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185170 77265140 1 O5N8C44H48 A5B8C44D48 -56.01 10.49 -8.74 -1.18 0
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185171 77265197 1 FN2O2C16H17 AB2C2D16E17 -60.15 3.94 -9.89 -0.47 0
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185172 77265579 1 N2F3O3C27H27 A2B3C3D27E27 -228.92 3.98 -9.32 -1.27 0
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185173 77265580 1 NO2C7H11 AB2C7D11 -69.06 4.94 -9.32 0.57 0
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185174 77265581 1 O3N4C30H30 A3B4C30D30 -4.99 8.63 -8.27 -1.04 0
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185175 77265582 1 N2O3C15H20 A2B3C15D20 -126.07 8.75 -9.54 0.06 0
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185176 77265683 1 O3N4H14C15 A3B4C14D15 -46.27 6.21 -9.39 -1.5 0
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185177 77266017 1 SN4O9C29H48 AB4C9D29E48 -409.51 4.63 -8.69 -0.58 0
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185178 77266105 1 Cl2O2F3N3H10C18 A2B2C3D3E10F18 -135.31 7.51 -9.24 -1.73 1
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185179 77266121 1 NPO9C50H91 ABC9D50E91 -422.86 8.1 0.0 0.0 0
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185180 77266479 1 Cl2O3N5C28H43 A2B3C5D28E43 -169.27 5.84 -9.23 -0.72 0
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185181 77266796 1 O4N6C41H50 A4B6C41D50 -132.45 6.31 -9.06 0.09 0
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185182 77266797 1 FN3O3C29H34 AB3C3D29E34 -115.15 3.3 -8.56 -0.26 0
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185183 77266905 1 FN3O5C22H22 AB3C5D22E22 -186.65 5.83 -9.22 -1.26 0
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185184 77266906 1 SO2N3C25H29 AB2C3D25E29 -29.45 4.1 -8.69 -0.57 0
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185185 77267228 1 ON7C30H35 AB7C30D35 69.69 9.56 -8.77 -1.14 0
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185186 77267469 1 N3O5C11H17 A3B5C11D17 -198.64 8.17 -9.81 0.05 0
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185187 77267470 1 ClNO6C15H18 ABC6D15E18 -273.98 3.46 -9.67 -0.46 0
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185188 77267569 1 O3C43H62 A3B43C62 -124.88 2.45 -8.81 -0.01 0
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185189 77267814 2 N6O7C18H33 A6B7C18D33 -691.21 8.72 -9.82 -0.05 0
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185190 77268440 1 ClN4O8C32H47 AB4C8D32E47 -362.77 8.52 -9.23 -1.1 0
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185191 77268441 1 N4O5C24H26 A4B5C24D26 -144.28 6.89 -8.72 -0.46 0
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185192 77268442 1 N3O4C23H37 A3B4C23D37 -203.42 5.75 -9.3 0.46 0
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185193 77268443 1 N3O6C24H35 A3B6C24D35 -273.15 4.9 -8.84 -0.52 0
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185194 77268444 1 F3N4O8C44H47 A3B4C8D44E47 -409.08 8.2 -8.93 -1.16 0