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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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188533 77729179 1 SN3O3C13H17 AB3C3D13E17 -85.68 6.37 -9.09 -0.44 0
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188534 77729180 1 FN4O4C20H27 AB4C4D20E27 -196.62 5.01 -9.68 -0.31 0
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188535 77729651 2 NO3C12H15 AB3C12D15 -237.54 6.65 -9.54 -0.15 0
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188536 77729777 1 SSi2O6C38H72 AB2C6D38E72 -457.76 4.81 -8.33 -0.09 0
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188537 77729858 1 FO3N5C10H14 AB3C5D10E14 -107.27 2.55 -9.68 -0.78 0
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188538 77730197 1 Cl2N2O6C25H28 A2B2C6D25E28 -241.96 5.8 -8.78 -1.19 0
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188539 77730198 1 OCl2N3C21H35 AB2C3D21E35 -121.26 8.72 -9.07 0.27 0
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188540 77730375 1 OF2C21H34 AB2C21D34 -194.29 4.61 -9.66 1.25 0
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188541 77730376 1 N4O5H34C35 A4B5C34D35 -53.49 2.62 -9.17 -0.57 0
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188542 77730494 1 N2O6C27H32 A2B6C27D32 -238.85 5.79 -8.53 -1.43 0
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188543 77730828 1 FN4O4C24H39 AB4C4D24E39 -256.69 5.49 -9.16 0.05 0
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188544 77730877 1 OF2C35H46 AB2C35D46 -156.87 2.34 -9.1 0.0 0
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188545 77731271 1 ON4C32H50 AB4C32D50 -56.72 2.71 -8.41 -0.11 0
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188546 77731505 1 NOF2C21H23 ABC2D21E23 -94.96 2.61 -9.1 0.0 0
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188547 77731506 2 NO3C13H17 AB3C13D17 -233.36 6.63 -9.1 -0.07 0
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188548 77732001 1 NO5C31H41 AB5C31D41 -192.02 3.73 -8.73 -0.05 0
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188549 77732002 1 FNSO4H12C17 ABCD4E12F17 -121.74 6.8 -9.09 -1.42 0
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188550 77732003 1 NCl2O3H19C27 AB2C3D19E27 -4.56 3.42 -8.78 -1.39 -1
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188551 77732004 1 FSN3O6H17C23 ABC3D6E17F23 -151.26 9.97 0.0 0.0 -1
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188552 77732005 1 FNSO4H9C16 ABCD4E9F16 -90.99 7.92 0.0 0.0 0
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188553 77732507 1 SO2F3N3C23H28 AB2C3D3E23F28 -207.5 6.01 -9.2 -0.37 0
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188554 77732508 3 ON2C14H16 AB2C14D16 -33.02 8.16 -8.96 -0.59 0
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188555 77732645 1 ClFNaN2O5C28H38 ABCD2E5F28G38 -270.83 6.95 0.0 0.0 0
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188556 77732871 1 Cl3N3O3C29H30 A3B3C3D29E30 -92.88 8.89 -9.12 -0.7 0
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188557 77733883 2 NO2C14H23 AB2C14D23 -221.24 5.36 -9.07 0.45 0