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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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389147 134991307 2 LiN2C16H18 AB2C16D18 56.2 4.92 -6.69 -0.03 0
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389149 134991313 1 FeLi2N4C20H48 AB2C4D20E48 161.91 3.3 -3.9 1.35 0
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389151 134991325 1 IrN2P2F6C25H47 AB2C2D6E25F47 -399.72 12.56 -8.99 -4.72 0
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389152 134991328 2 NC6H11 AB6C11 6.48 1.52 -8.68 1.34 0
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389153 134991339 1 VCl2O2C6H14 AB2C2D6E14 -199.44 5.16 0.0 0.0 0
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389154 134991344 1 PdP2C24H38 AB2C24D38 39.31 1.38 -6.98 0.08 0
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389155 134991354 2 C7H13 A7B13 -43.36 0.88 -9.52 1.54 0
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389156 134991356 1 CoN4O8C24H40 AB4C8D24E40 -389.43 24.24 0.0 0.0 0
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389157 134991371 1 P2O6H38C43 A2B6C38D43 -150.38 4.61 -9.02 -0.22 0
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389158 134991372 1 P2O6C51H54 A2B6C51D54 -208.92 4.26 -8.82 -0.18 0
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389160 134991376 1 P2O6F12H56C73 A2B6C12D56E73 -684.82 6.5 -9.39 -1.38 0
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389161 134991377 1 BrMgSe ABC 3.01 0.87 0.0 0.0 1
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389162 134991378 1 MgSe AB 62.7 8.25 -7.46 -2.17 0
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389163 134991379 1 P2O3Ru3H30C31 A2B3C3D30E31 278.41 6.82 -8.75 -5.03 0
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389164 134991380 2 BNaO3 ABC3 -266.21 3.53 -7.92 0.4 0
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389165 134991382 2 PC9H14 AB9C14 -40.43 2.04 -8.17 0.34 0
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389166 134991384 1 OSi2N3C24H45 AB2C3D24E45 -136.44 6.1 -8.6 0.16 0
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389167 134991385 1 FeOP2H36C42 ABC2D36E42 63.33 23.49 -5.34 -1.22 0
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389168 134991386 1 OP2H31C37 AB2C31D37 123.44 0.51 0.0 0.0 0
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389169 134991388 1 OP2H39C41 AB2C39D41 81.78 2.33 0.0 0.0 0
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389171 134991390 1 RuSbP2O3H25F26C50 ABC2D3E25F26G50 -1199.9 16.19 -8.72 -2.81 0
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389172 134991391 1 RuSbP2O3F26H33C54 ABC2D3E26F33G54 -1214.1 12.74 -8.48 -3.01 0
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389173 134991392 2 OPF10H10C21 ABC10D10E21 -885.57 2.7 -9.16 -1.47 0
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389175 134991394 1 RuN4H12C20 AB4C12D20 492.45 3.67 -6.95 -3.07 0
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389176 134991395 1 SO3C14H20 AB3C14D20 -94.76 5.03 -9.99 -0.4 0
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389177 134991396 1 N2O2C35H36 A2B2C35D36 20.24 2.82 -8.34 -0.45 0
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389178 134991397 2 O2N3C29H32 A2B3C29D32 13.08 5.32 -8.39 -0.64 0
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389179 134991398 1 ClN2O4C27H29 AB2C4D27E29 -107.52 2.88 -8.58 -1.01 0
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389180 134991404 1 NSF4O4C10H15 ABC4D4E10F15 -359.34 15.54 -10.43 -1.01 -1
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389183 134991420 1 FeNC25H33 ABC25D33 244.0 13.68 -5.4 -3.85 0
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389184 134991421 1 FeNOP2C53H57 ABCD2E53F57 65.3 5.43 -6.54 0.0 0
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389185 134991422 1 NOP2C48H52 ABC2D48E52 49.36 4.37 0.0 0.0 -1
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389187 134991436 1 CoC5N5 AB5C5 245.01 0.06 -5.92 -2.1 0
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389188 134991452 2 CoZnC4O4 ABC4D4 -419.1 25.88 -9.91 -6.41 0
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389189 134991466 1 PPtH19C20 ABC19D20 174.02 1.53 -9.1 -2.04 0
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389190 134991467 1 AlLiO3C30H63 ABC3D30E63 -325.57 1.99 0.0 0.0 -1
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389191 134991468 1 AlO3C30H63 AB3C30D63 -372.58 0.68 -9.69 2.18 0
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389192 134991493 1 MoO6C10H16 AB6C10D16 -54.31 12.94 -7.79 -2.22 0
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389193 134991511 1 BrNiP2C12H30 ABC2D12E30 -150.28 9.21 0.0 0.0 0
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389194 134991512 1 NC15H29 AB15C29 -48.58 1.98 -9.1 1.46 0
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389196 134991520 1 PO3H10C12 AB3C10D12 -26.67 1.28 0.0 0.0 0
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389197 134991526 2 OC8H10 AB8C10 -60.53 2.08 -9.57 0.08 0
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389199 134991539 1 TiF2C20H24 AB2C20D24 -126.34 5.68 -7.25 -2.3 0
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389200 134991540 1 CuOSC7H7 ABCD7E7 21.26 4.36 -6.99 0.6 -2
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389202 134991564 1 PC28H37 AB28C37 -12.81 2.32 -8.08 -0.12 -2
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389203 134991565 4 HRhC3O3 ABC3D3 -507.89 21.24 -10.51 -5.19 0
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389204 134991570 1 NB3C16H36 AB3C16D36 367.3 14.86 -3.16 -0.84 0
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389205 134991573 1 CoN2O4C38H52 AB2C4D38E52 -189.16 52.97 0.0 0.0 -2
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389208 134991579 1 NRuSO2C36H43 ABCD2E36F43 77.47 13.95 -8.07 -3.71 0
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389209 134991580 1 NSO2C24H27 ABC2D24E27 -44.15 4.85 -9.16 -0.2 0
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389210 134991582 1 AlLiN2O4C46H46 ABC2D4E46F46 -165.45 7.68 -8.13 -0.21 0
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389211 134991598 1 NRuO2H17C18 ABC2D17E18 62.68 7.0 -8.56 -2.59 0
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389213 134991606 4 CoC3O3 AB3C3 -458.01 24.74 -10.67 -8.29 0
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389215 134991614 1 YC6H8 AB6C8 -2.12 0.39 0.0 0.0 0
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389217 134991624 1 HIrKNOCl5 ABCDEF5 -110.92 5.84 0.0 0.0 0
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389218 134991635 1 NCl3O3C10H12 AB3C3D10E12 -144.29 3.82 -10.21 -0.71 0
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389219 134991636 1 O5C11H16 A5B11C16 -206.23 1.38 -10.1 0.45 0
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389221 134991639 1 NO4C10H17 AB4C10D17 -115.36 2.8 -10.1 -0.74 0
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389222 134991679 1 AlLiO3H15C21 ABC3D15E21 -136.41 4.79 0.0 0.0 0
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389223 134991684 1 NOH7C8F10 ABC7D8E10 -490.05 4.1 -11.19 -0.7 0
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389224 134991685 2 ClRuSeC11H18 ABCD11E18 102.81 6.15 -7.78 -3.65 0
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389226 134991695 1 FePC25H25 ABC25D25 276.58 16.24 -6.01 -3.37 -1
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389227 134991708 1 ISnCl4 ABC4 -86.65 1.09 0.0 0.0 0
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389228 134991710 1 C15H16 A15B16 109.79 1.09 -9.18 0.11 0
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389229 134991712 2 C6H11 A6B11 -34.68 0.88 -9.61 1.46 0
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389230 134991720 1 ClOSeC15H17 ABCD15E17 -25.95 3.01 -8.95 -0.91 -2
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389232 134991729 1 GaNaO4H24C40 ABC4D24E40 -76.51 16.77 -7.48 -1.7 0
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389233 134991730 1 LiNC19H26 ABC19D26 -9.63 5.7 -6.95 1.03 0
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389234 134991763 1 BrNF48H64C132 ABC48D64E132 -1989.78 17.52 -7.15 -3.77 0
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389237 134991779 1 NO6C21H33 AB6C21D33 -273.88 3.88 -8.12 -0.58 1
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389238 134991782 1 NC25H50 AB25C50 -74.55 1.64 0.0 0.0 0
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389239 134991784 1 ClNOSiC15H16 ABCDE15F16 -75.72 3.58 -9.25 -0.01 0
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389240 134991789 1 NPRuCl2C26H36 ABCD2E26F36 113.01 12.14 -7.04 -0.98 -1
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389245 134991805 1 MoNCl2O2C35H48 ABC2D2E35F48 -15.57 15.45 0.0 0.0 -2
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389246 134991823 2 HReC5O5 ABC5D5 -58.91 9.81 -7.98 -2.54 0