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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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179434 76482852 1 N4O5C27H28 A4B5C27D28 -131.19 6.39 -8.9 -0.6 0
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179435 76483019 1 NO4C29H39 AB4C29D39 -169.71 2.95 -8.12 0.47 0
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179436 76483163 1 ON3C17H21 AB3C17D21 19.7 2.12 -8.68 -0.16 0
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179437 76483164 1 S2N6O13C35H40 A2B6C13D35E40 -342.04 11.18 -8.96 -1.27 0
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179438 76483165 1 SN2O6C21H28 AB2C6D21E28 -232.97 7.78 -9.54 -0.33 0
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179439 76483166 1 ON6C29H34 AB6C29D34 93.75 9.16 -8.44 -0.37 0
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179440 76483167 1 N2O2C19H24 A2B2C19D24 -67.42 2.99 -8.15 0.21 0
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179441 76483171 1 O6C31H48 A6B31C48 -343.39 7.18 -9.51 0.52 0
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179442 76483637 1 I2C7H12 A2B7C12 -2.85 3.98 -8.83 -1.08 1
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179443 76483688 1 N4O7C28H37 A4B7C28D37 -262.42 3.1 0.0 0.0 1
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179444 76483960 1 ClO4N6C22H22 AB4C6D22E22 -15.46 1.7 0.0 0.0 0
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179445 76484344 2 OC31H50 AB31C50 -222.37 1.71 -8.4 -0.17 0
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179446 76484408 1 IS2N5O7C40H40 AB2C5D7E40F40 -107.58 6.22 -8.91 -1.72 0
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179447 76484584 1 O5C27H42 A5B27C42 -285.33 2.62 -9.32 0.77 1
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179448 76484617 1 SN3O6C23H36 AB3C6D23E36 -266.29 4.72 0.0 0.0 0
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179449 76485090 1 N5O7C31H47 A5B7C31D47 -311.74 6.01 -9.21 0.09 0
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179450 76485091 1 O5C21H36 A5B21C36 -273.26 5.09 -9.82 0.54 0
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179451 76485248 1 O3N6C13H18 A3B6C13D18 -30.52 1.95 -9.07 -0.5 1
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179452 76485249 1 ClS3N4O7C28H36 AB3C4D7E28F36 -248.99 9.37 0.0 0.0 0
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179453 76485250 1 ClS2N5O9C24H28 AB2C5D9E24F28 -327.37 1.25 -9.16 -1.2 1
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179454 76485251 1 BrNCl2O4C16H17 ABC2D4E16F17 -159.51 3.56 0.0 0.0 1
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179455 76485252 1 BrN3O6C19H19 AB3C6D19E19 -174.88 9.59 0.0 0.0 0
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179456 76485253 1 N4O6H18C23 A4B6C18D23 -115.73 9.8 -9.5 -1.97 0
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179457 76485312 1 NO4C16H25 AB4C16D25 -84.05 2.1 -9.06 0.6 0
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179458 76486082 1 FNO3C36H52 ABC3D36E52 -230.04 5.34 -8.71 0.0 0