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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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225662 87225335 1 SN6O7H26C27 AB6C7D26E27 -196.32 9.27 -8.78 -1.82 0
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225663 87225336 1 SN6O7H24C26 AB6C7D24E26 -188.3 10.0 -9.02 -1.97 0
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225664 87225337 1 N7O8C30H31 A7B8C30D31 -251.83 2.27 -8.34 -1.47 0
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225665 87225338 1 SN5O6C28H37 AB5C6D28E37 -204.76 7.87 -8.83 -0.89 0
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225666 87225339 1 NSO4C11H17 ABC4D11E17 -140.13 5.45 -9.91 -0.36 1
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225667 87225340 1 NSO5C11H14 ABC5D11E14 -140.74 4.15 0.0 0.0 0
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225668 87225341 1 SN6O6H18C21 AB6C6D18E21 -103.71 7.82 -8.96 -1.97 0
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225669 87225342 1 NSO5C9H19 ABC5D9E19 -213.13 13.45 -9.86 -0.43 1
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225670 87225343 1 NSO5C9H20 ABC5D9E20 -218.89 2.7 0.0 0.0 0
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225671 87225344 1 BrOSN3C4H4 ABCD3E4F4 -12.54 2.23 -9.32 -2.48 0
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225672 87225345 1 F3O5N6C30H35 A3B5C6D30E35 -306.35 8.64 -8.8 -1.0 0
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225673 87225346 1 BrNOC11H24 ABCD11E24 -65.01 4.82 -9.04 0.02 0
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225674 87225347 1 BrNO2C11H22 ABC2D11E22 -97.62 12.69 -7.88 -0.76 0
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225675 87225348 1 O7N8C30H32 A7B8C30D32 -216.64 9.04 -8.46 -1.68 0
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225676 87225349 1 SN6O9C28H28 AB6C9D28E28 -284.57 12.54 -8.8 -1.83 0
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225677 87225350 1 SO6N7H23C28 AB6C7D23E28 -39.07 10.52 -9.22 -1.86 0
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225678 87225351 1 BrO4C11H13 AB4C11D13 -120.18 4.53 -9.49 -0.59 0
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225679 87225352 1 ClNO3C12H24 ABC3D12E24 -155.89 2.98 -8.59 -0.36 0
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225680 87225353 1 NO3C9H15 AB3C9D15 -91.79 4.9 -10.1 -0.11 0
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225681 87225354 1 SO5N6C24H24 AB5C6D24E24 -115.04 6.99 -8.56 -1.67 3
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225683 87225356 2 SN3O3H10C11 AB3C3D10E11 -141.77 10.79 -8.96 -1.72 0
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225684 87225357 1 SO6N7H23C24 AB6C7D23E24 -147.92 11.8 -8.51 -1.62 0
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225685 87225358 1 SO6N7H23C24 AB6C7D23E24 -149.63 9.02 -8.75 -1.84 0
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225686 87225359 1 SN6O7C25H26 AB6C7D25E26 -197.99 11.02 -8.6 -1.7 0
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225687 87225360 2 O3N4C17H22 A3B4C17D22 -173.01 8.51 -8.35 -1.58 0