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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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221690 85285977 1 BrNO2C34H60 ABC2D34E60 -104.67 69.71 -4.58 -2.68 0
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221691 85285980 1 SiO4C37H58 AB4C37D58 -208.93 2.08 -8.46 0.57 0
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221692 85285983 1 O6N7H29C31 A6B7C29D31 -157.87 11.86 -8.56 -1.04 0
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221693 85285988 1 ClN3O6C32H38 AB3C6D32E38 16.0 4.91 -7.88 -2.46 0
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221694 85285994 2 N2O4C15H26 A2B4C15D26 -420.39 3.92 -10.07 -0.36 0
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221695 85285995 1 SN2O5C34H48 AB2C5D34E48 -243.06 1.43 -8.41 -0.42 0
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221696 85285998 1 NO3C41H43 AB3C41D43 -2.52 2.87 -8.63 0.09 0
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221697 85285999 1 NSi2O4C34H55 AB2C4D34E55 -279.65 1.78 -8.72 0.07 0
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221698 85286000 1 PF2N2O11C24H39 AB2C2D11E24F39 -699.06 4.5 -9.98 0.04 1
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221699 85286009 1 PN3C15H27 AB3C15D27 1.78 9.57 0.0 0.0 0
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221700 85286013 1 FN2Si2O7C29H37 AB2C2D7E29F37 -371.49 5.36 -9.04 -0.9 0
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221701 85286016 1 Cl2N2O6C31H34 A2B2C6D31E34 -222.41 4.95 -8.21 -0.25 0
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221702 85286053 2 O6H15C16 A6B15C16 -446.57 2.11 -9.98 -0.86 0
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221703 85286057 1 N2O7C34H60 A2B7C34D60 -283.54 4.18 -7.47 0.33 0
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221705 85286059 1 BrN2O3H33C35 AB2C3D33E35 -36.4 2.36 -8.75 -0.51 0
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221706 85286060 1 N3O9C32H39 A3B9C32D39 -334.46 8.16 -8.87 -0.34 0
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221707 85286061 1 N3O5H31C38 A3B5C31D38 2.07 7.24 -9.03 -0.86 0
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221708 85286062 1 SiN3O8C31H41 AB3C8D31E41 -370.58 3.11 -9.15 -0.13 0
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221709 85286063 1 O5N7C32H47 A5B7C32D47 -231.25 4.54 -8.7 -0.24 0
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221710 85286064 1 N2F3O8H25C31 A2B3C8D25E31 -378.92 4.94 -9.71 -1.02 0
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221711 85286065 1 N2O8H34C35 A2B8C34D35 -235.43 4.03 -8.92 -0.74 0
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221712 85286066 2 O2C21H21 A2B21C21 -85.92 4.42 -9.53 -0.62 0
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221713 85286067 1 O3N4C38H50 A3B4C38D50 -83.77 7.43 -8.53 -0.02 0
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221714 85286068 1 ClO15C25H35 AB15C25D35 -667.04 3.4 -10.31 -0.87 0
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221715 85286069 1 NI2O6C19H19 AB2C6D19E19 -102.2 4.93 -8.66 -1.03 0
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221716 85286070 1 BrS2O8C26H27 AB2C8D26E27 -276.03 10.51 -9.1 -0.85 0
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221717 85286071 1 N3O7C35H37 A3B7C35D37 -184.03 2.19 -8.67 -0.74 0
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221718 85286072 1 SO7N9C25H41 AB7C9D25E41 -304.47 10.58 -8.8 -0.16 0
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221719 85286073 1 N5O5C35H41 A5B5C35D41 -124.48 5.59 -9.24 0.03 0
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221721 85286075 2 NO5C16H20 AB5C16D20 -345.63 5.19 -9.5 -0.79 0
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221722 85286076 1 SiN2O2C40H44 AB2C2D40E44 -18.15 3.78 -8.09 0.14 0
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221723 85286077 1 N3O10C31H39 A3B10C31D39 -431.96 2.52 -8.93 -0.48 0
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221724 85286078 1 N3O5C37H47 A3B5C37D47 -200.63 3.49 -8.8 -0.08 0
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221725 85286079 1 ClON3S3H28C33 ABC3D3E28F33 76.8 3.66 -8.0 -1.01 0
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221726 85286080 1 N6O8H30C31 A6B8C30D31 -242.5 10.19 -10.0 -1.05 0
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221727 85286081 1 PN2O7C34H35 AB2C7D34E35 -267.8 1.99 -9.36 -0.3 0
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221728 85286082 1 N2O3C41H46 A2B3C41D46 -37.28 6.32 -8.84 -0.44 0
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221730 85286085 1 P2N5O14C19H31 A2B5C14D19E31 -695.03 1.75 -9.28 -0.74 0
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221731 85286086 1 S2N3O7H25C31 A2B3C7D25E31 -126.77 5.08 -8.94 -0.9 0
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221733 85286088 1 SN3O6C34H39 AB3C6D34E39 -175.75 6.8 -9.16 -0.19 0
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221734 85286089 1 N3S3O7C27H41 A3B3C7D27E41 -310.68 3.07 -8.58 -0.82 0
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221736 85286091 1 ClPSiN3O6C29H37 ABCD3E6F29G37 -297.77 9.34 -9.39 -0.44 0
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221737 85286092 1 ClS4O5N7C21H22 AB4C5D7E21F22 -65.49 4.16 -8.81 -0.94 0
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221738 85286093 1 ClS4O5N7C21H22 AB4C5D7E21F22 -47.85 9.85 -8.77 -1.35 0
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221739 85286094 1 BrNSO9H22C27 ABCD9E22F27 -262.48 2.54 -9.15 -1.52 0
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221740 85286095 1 Cl2N3O3H23C36 A2B3C3D23E36 40.75 9.2 -9.22 -1.28 0
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221741 85286096 1 O13C31H36 A13B31C36 -533.6 4.99 -8.57 -0.22 0
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221742 85286097 11 OC3H4 AB3C4 -430.01 7.61 -9.52 0.18 0
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221743 85286098 1 S3O6N8C24H24 A3B6C8D24E24 -44.18 6.24 -9.08 -1.07 0
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221744 85286099 1 SN2O5H32C37 AB2C5D32E37 -52.66 4.22 -8.99 -0.38 0