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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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412361 135085251 1 ClNPRuC20H21 ABCDE20F21 100.17 23.54 -6.73 -1.28 3
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412363 135085253 1 FeS2F6N6O6C26H36 AB2C6D6E6F26G36 -496.81 6.47 -8.14 -2.28 -1
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412365 135085255 1 IrOP2C20H38 ABC2D20E38 -43.47 19.8 0.0 0.0 0
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412366 135085256 1 FeS2N4F6O6C30H32 AB2C4D6E6F30G32 -480.71 5.94 -8.08 -1.49 0
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412367 135085257 4 NC7H8 AB7C8 85.29 3.02 -8.07 -0.47 3
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412368 135085258 1 MnN2O2C28H38 AB2C2D28E38 -7.95 4.14 0.0 0.0 0
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412369 135085259 1 PdO2P2H10 AB2C2D10 -27.78 1.95 -7.35 1.14 0
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412370 135085260 1 NYSi2C8H24 ABC2D8E24 -189.68 4.31 -7.85 -0.13 0
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412371 135085261 1 AlLiNC15H33 ABCD15E33 -67.17 6.84 -7.17 3.2 -1
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412372 135085262 1 AlNC15H33 ABC15D33 -67.97 5.86 0.0 0.0 0
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412373 135085263 1 OC14H22 AB14C22 -28.33 1.25 -9.39 1.02 0
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412374 135085265 1 IOC13H15 ABC13D15 18.52 2.2 -9.07 -1.07 0
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412375 135085266 1 ON2H14C15 AB2C14D15 21.9 5.86 -9.47 -0.66 1
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412376 135085267 1 ClN2H10C12 AB2C10D12 55.22 4.53 0.0 0.0 0
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412377 135085268 1 NOH13C14 ABC13D14 13.54 6.15 -8.68 -0.67 0
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412378 135085269 1 NO4C8H9 AB4C8D9 -91.12 4.29 -9.7 -0.63 0
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412379 135085270 1 NaN2O2C19H21 AB2C2D19E21 -0.07 23.08 -6.38 -1.02 0
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412380 135085271 2 RhC2O2H4 AB2C2D4 -201.57 8.61 -9.1 -4.82 0
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412381 135085272 1 BON3F4C22H24 ABC3D4E22F24 -312.92 11.89 -9.68 -1.29 -1
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412383 135085274 1 OPN3C15H18 ABC3D15E18 -59.5 5.26 -8.73 -0.46 0
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412384 135085275 1 ClON3F6H14C20 ABC3D6E14F20 -241.88 11.46 -7.22 -2.74 0
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412385 135085276 1 BOSiN3F4C29H34 ABCD3E4F29G34 -337.39 12.71 -9.26 -1.28 1
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412386 135085277 1 OSiN3C29H34 ABC3D29E34 27.28 2.46 0.0 0.0 0
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412388 135085279 1 RuS2F3N3O4C33H36 AB2C3D3E4F33G36 -92.48 14.44 -7.91 -2.51 0
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412389 135085280 1 NOC20H29 ABC20D29 -39.26 1.38 -9.1 0.52 3