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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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126961 50985641 1 SN5C17H29 AB5C17D29 41.65 5.61 -8.69 0.04 0
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126962 50985685 1 BrClN3O4H21C24 ABC3D4E21F24 -103.33 3.92 -8.96 -0.65 0
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126963 50985791 1 NO2S2C20H27 AB2C2D20E27 -84.26 4.83 -8.74 0.08 0
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126964 50985802 1 NOS2C20H27 ABC2D20E27 -55.13 5.05 -8.57 -0.14 0
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126965 50985818 1 ON4H20C24 AB4C20D24 110.39 3.12 -8.29 -0.22 0
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126966 50985865 4 NOC6H7 ABC6D7 -110.57 4.81 -9.34 -0.44 0
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126967 50985866 1 O3N4C27H28 A3B4C27D28 -54.82 9.55 -9.07 -0.66 0
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126968 50985867 1 O3N4C23H26 A3B4C23D26 -77.93 7.84 -9.41 -0.52 0
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126969 50985871 1 SN3O6C26H33 AB3C6D26E33 -215.45 4.45 -8.96 -0.28 0
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126970 50985872 1 ClN3O4C25H28 AB3C4D25E28 -138.11 5.59 -8.87 -0.67 -4
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126971 50986093 1 SP3N7O19C48H74 AB3C7D19E48F74 -962.3 1.35 -9.46 -1.33 0
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126972 50986175 1 O7H16C19 A7B16C19 -234.34 1.66 -9.81 -1.91 -4
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126973 50986176 1 SP3N7O17C28H40 AB3C7D17E28F40 -741.21 19.34 -9.03 -1.99 0
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126974 50986294 1 NOS2H9C10 ABC2D9E10 13.23 4.55 -9.05 -1.1 0
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126975 50986416 2 NOC5H9 ABC5D9 -76.58 2.79 -9.54 0.88 0
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126976 50986417 1 NF3O3C12H18 AB3C3D12E18 -313.95 2.99 -9.89 0.64 0
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126977 50986418 1 N2O2C11H20 A2B2C11D20 -99.67 3.36 -9.05 0.92 0
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126978 50986481 1 N3O3C16H29 A3B3C16D29 -178.51 2.88 -8.87 0.71 0
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126979 50986499 1 N3O3C13H25 A3B3C13D25 -174.58 3.84 -9.54 0.79 0
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126980 50986500 1 N3O3C12H23 A3B3C12D23 -161.7 4.74 -9.24 0.76 0
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126981 50986501 1 NF3O4C11H18 AB3C4D11E18 -380.09 6.08 -10.31 0.21 0
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126982 50986507 1 NOF2C10H13 ABC2D10E13 -139.02 4.17 -9.28 -0.06 0
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126983 50986560 1 O5C41H68 A5B41C68 -175.37 3.83 -8.78 -0.76 0
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126984 50986561 1 OC27H46 AB27C46 -127.2 2.42 -9.15 1.41 0
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126985 50986565 2 ClOC17H24 ABC17D24 -149.21 3.43 -9.3 -1.06 0