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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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173084 75593936 1 ON3C16H19 AB3C16D19 28.16 6.52 -9.1 -1.14 0
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173085 75594305 2 NOC10H12 ABC10D12 -25.51 4.83 -9.02 -0.04 0
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173086 75594590 1 SO3N4H16C17 AB3C4D16E17 -57.99 1.54 -9.27 -1.27 0
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173087 75594722 1 ON5H15C18 AB5C15D18 116.29 10.89 -7.96 -1.52 0
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173088 75594840 1 ClN2O3C17H23 AB2C3D17E23 -123.12 6.07 -8.8 -0.14 0
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173089 75595044 2 N2O2C9H12 A2B2C9D12 -153.15 3.54 -8.51 0.19 0
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173090 75595045 1 O2N3C22H29 A2B3C22D29 -42.31 4.44 -9.12 0.37 0
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173091 75595046 1 N3O3H13C16 A3B3C13D16 14.5 5.23 -9.17 -2.6 0
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173092 75595047 1 ON6C17H26 AB6C17D26 -17.01 3.65 -8.56 0.03 0
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173093 75595160 1 SN2O4C16H22 AB2C4D16E22 -157.56 2.7 -8.96 -0.39 0
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173094 75595325 1 NO3C17H23 AB3C17D23 -109.13 1.39 -8.67 0.04 0
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173095 75595774 1 N3O3C29H31 A3B3C29D31 -76.31 4.72 -9.15 -0.75 0
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173097 75596060 1 N3P3C9O13H14 A3B3C9D13E14 -679.55 8.56 -9.06 -0.59 0
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173098 75596347 1 N9O11C42H59 A9B11C42D59 -493.49 5.43 -9.4 -0.21 0
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173099 75596348 1 O11N12C35H56 A11B12C35D56 -498.87 9.88 -9.3 -0.15 0
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173100 75596483 1 ON8H20C30 AB8C20D30 224.97 12.65 -8.8 -2.56 0
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173101 75597069 1 NO7C20H25 AB7C20D25 -296.92 2.13 -8.18 0.49 0
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173102 75597241 1 N2O3C35H54 A2B3C35D54 -177.46 3.67 -8.75 0.28 0
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173103 75597279 1 OC40H60 AB40C60 -53.57 1.88 -8.0 -0.21 0
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173104 75597363 1 SN2O3C23H28 AB2C3D23E28 -105.56 2.59 -8.98 -0.54 0
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173105 75597364 3 OC9H10 AB9C10 -63.01 3.98 -8.51 0.13 0
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173106 75597365 1 O13C38H62 A13B38C62 -647.4 4.37 -9.79 0.83 0
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173107 75597366 1 O13C25H42 A13B25C42 -614.69 5.8 -10.12 -0.38 0
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173108 75597557 1 N2O4C23H30 A2B4C23D30 -59.71 6.43 -7.64 0.18 1
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173109 75597558 1 N2O4C23H31 A2B4C23D31 -114.36 4.31 0.0 0.0 0
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173110 75598296 1 O2N4C15H20 A2B4C15D20 -35.13 2.92 -8.54 -0.73 0
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173111 75598297 1 N5O6H21C22 A5B6C21D22 -147.81 5.76 -9.07 -0.7 0
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173112 75598431 1 N4O5C44H44 A4B5C44D44 -116.96 4.67 -9.17 -0.86 0
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173113 75599053 1 N3O6C24H31 A3B6C24D31 -143.81 9.2 -8.6 -1.21 0
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173114 75599385 1 S2N7O7C35H45 A2B7C7D35E45 -210.11 8.92 -8.55 -1.0 0
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173115 75599702 1 O5C22H36 A5B22C36 -283.23 2.57 -9.37 0.86 0
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173116 75599703 2 O10C15H16 A10B15C16 -806.26 6.52 -9.49 -1.72 0
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173117 75599704 1 FNSO5C22H30 ABCD5E22F30 -224.67 6.91 -9.41 -0.33 0
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173118 75600560 1 NO5C27H27 AB5C27D27 -158.57 1.86 -8.87 -0.42 0
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173119 75600725 1 NO3H11C19 AB3C11D19 110.5 5.48 -10.12 -1.73 0
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173120 75600832 1 O9C34H42 A9B34C42 -386.44 5.74 -9.57 -0.46 2
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173121 75600833 1 ClFeN4C23H23 ABC4D23E23 269.62 5.21 -8.07 -0.78 0
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173122 75600834 1 ClN4C18H18 AB4C18D18 125.32 2.88 0.0 0.0 0
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173123 75600863 1 N2O5C30H36 A2B5C30D36 -158.07 4.16 -8.26 0.1 0
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173124 75600864 1 N2O3C13H14 A2B3C13D14 -40.82 4.81 -8.77 -1.01 0
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173125 75601068 1 NiN3O4H37C40 AB3C4D37E40 78.17 3.46 -8.66 -1.16 0
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173126 75601150 1 NC16H21 AB16C21 32.14 2.15 -7.84 0.06 0
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173127 75601419 1 ClSO4N6C18H21 ABC4D6E18F21 3.99 3.04 -9.49 -1.19 1
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173128 75601480 1 O2N4C33H41 A2B4C33D41 -53.19 3.14 0.0 0.0 0
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173129 75602119 1 O7C16H22 A7B16C22 -299.05 3.09 -9.89 -0.16 0
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173130 75602944 1 N7O7C36H45 A7B7C36D45 -261.02 3.58 -8.53 -0.4 0
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173131 75602945 1 O4N7C36H41 A4B7C36D41 -80.33 5.93 -8.48 -0.69 0
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173132 75602946 1 O4N7C44H45 A4B7C44D45 -36.82 3.54 -8.84 -0.8 0
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173133 75602947 1 O2N11C36H37 A2B11C36D37 86.61 6.56 -8.47 -0.77 0
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173134 75602948 1 N9O10C44H55 A9B10C44D55 -352.39 5.62 -8.74 -0.92 0