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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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237619 92720041 1 O2N4C27H30 A2B4C27D30 -20.42 3.4 -9.12 -0.25 0
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237620 92720042 1 O2N4C27H30 A2B4C27D30 -22.07 3.6 -9.11 -0.3 0
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237621 92720043 1 O2N4C27H30 A2B4C27D30 -19.63 2.85 -9.08 -0.34 0
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237622 92720045 1 N3O4C25H33 A3B4C25D33 -142.14 2.36 -8.66 -0.16 0
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237623 92720049 1 ClO2N3C22H26 AB2C3D22E26 -60.34 2.88 -9.12 -0.61 0
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237624 92720050 1 ClO2N3C22H26 AB2C3D22E26 -61.34 3.83 -9.15 -0.57 0
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237625 92720054 1 N3O3C24H31 A3B3C24D31 -100.21 5.49 -8.77 -0.08 0
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237626 92720056 1 O2N3C19H29 A2B3C19D29 -84.75 3.09 -8.4 0.16 0
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237627 92720057 1 O2N3C19H29 A2B3C19D29 -79.06 3.0 -8.23 0.3 0
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237628 92720061 1 ON4C21H26 AB4C21D26 6.72 3.48 -9.25 -0.57 0
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237629 92720063 1 NSH17C20 ABC17D20 93.12 3.27 -8.24 0.09 0
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237630 92720064 1 N3O6C19H25 A3B6C19D25 -179.25 3.84 -8.94 -0.46 0
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237631 92720065 1 N3O6C19H25 A3B6C19D25 -179.25 3.69 -8.85 -0.27 0
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237632 92720066 2 NO2C8H12 AB2C8D12 -145.06 5.12 -8.11 -0.54 0
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237633 92720067 2 NO2C8H12 AB2C8D12 -140.34 7.11 -8.65 -0.47 0
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237634 92720068 1 N3O4C24H31 A3B4C24D31 -112.25 3.77 -8.38 -0.68 0
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237635 92720069 2 NC4H9 AB4C9 6.93 1.13 -8.74 2.53 0
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237636 92720070 2 NC4H9 AB4C9 9.34 0.91 -8.56 2.41 0
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237637 92720072 1 NOC8H17 ABC8D17 -40.76 1.66 -8.76 2.27 0
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237639 92720085 1 NC10H19 AB10C19 -28.05 2.05 -8.81 3.28 0
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237641 92720112 1 OSCl2N4H18C23 ABC2D4E18F23 71.74 7.1 -9.25 -1.29 0
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237642 92720121 1 N3O5C23H31 A3B5C23D31 -221.91 6.78 -9.5 -0.27 0
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237643 92720122 1 N3O5C23H31 A3B5C23D31 -224.13 6.91 -9.35 -0.26 0
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237644 92720124 2 NO2C14H17 AB2C14D17 -140.62 2.08 -9.45 -0.59 0
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237645 92720128 1 SN3O5H25C26 AB3C5D25E26 -115.59 3.84 -8.94 -1.26 0
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237646 92720144 1 NO2C7H15 AB2C7D15 -87.96 3.39 -9.56 1.92 0
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237647 92720153 1 N2O4C21H22 A2B4C21D22 -90.99 8.45 -8.95 -0.95 0
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237648 92720154 2 NC4H9 AB4C9 6.89 0.44 -8.61 2.43 0
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237649 92720161 1 SN2O5C22H28 AB2C5D22E28 -180.2 2.92 -9.76 -1.48 0
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237650 92720170 2 NO3C13H17 AB3C13D17 -239.78 1.03 -8.5 -0.73 0
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237651 92720176 1 ClSO2N5C23H28 ABC2D5E23F28 -63.87 6.06 -9.36 -1.1 0
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237652 92720180 1 ClFSN3O3H21C25 ABCD3E3F21G25 -44.27 5.39 -9.32 -1.12 0
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237653 92720222 1 SN4O4C26H26 AB4C4D26E26 -92.22 9.29 -9.1 -1.34 0
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237654 92720231 2 OSN2H12C13 ABC2D12E13 14.52 1.93 -8.94 -1.38 0
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237655 92720233 1 SN3O3C23H27 AB3C3D23E27 -60.67 4.01 -8.36 -0.42 0
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237656 92720235 1 N2O6C27H34 A2B6C27D34 -227.1 3.89 -9.12 -0.17 0
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237657 92720242 1 ClFN2O5C25H28 ABC2D5E25F28 -237.07 9.65 -9.21 -0.3 0
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237658 92720243 1 ClFN2O5C25H28 ABC2D5E25F28 -237.17 8.12 -8.87 -0.71 0
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237659 92720244 1 ClFN2O5C25H28 ABC2D5E25F28 -241.46 5.06 -9.22 -0.7 0
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237660 92720245 1 ClFN2O5C25H28 ABC2D5E25F28 -237.81 4.55 -9.06 -0.76 0
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237661 92720250 1 N2O5C26H32 A2B5C26D32 -186.81 5.54 -8.96 0.04 0
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237662 92720273 1 N3O7C26H31 A3B7C26D31 -198.66 7.92 -9.27 -1.29 0
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237663 92720354 1 SN4O5C21H26 AB4C5D21E26 -125.63 5.23 -9.59 -1.44 0
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237664 92720421 1 ClN3O7H14C20 AB3C7D14E20 -102.08 3.83 -9.88 -2.24 0
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237665 92720471 1 SF3N4O4H17C22 AB3C4D4E17F22 -228.7 6.3 -9.14 -1.33 0
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237666 92720527 1 S2N3O3C23H25 A2B3C3D23E25 -55.49 3.24 -8.8 -1.28 0
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237667 92720545 1 FN2O5H13C15 AB2C5D13E15 -204.82 4.03 -9.52 -1.36 0
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237668 92720549 1 FNO4H16C20 ABC4D16E20 -131.74 3.75 -8.84 -1.34 0
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237669 92720553 1 FNO5H18C22 ABC5D18E22 -172.12 4.52 -9.16 -0.97 0
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237670 92720554 1 FNO5H18C22 ABC5D18E22 -173.02 5.12 -9.27 -1.1 0