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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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190719 78047012 1 O2N7H21C27 A2B7C21D27 89.26 11.38 -9.31 -1.1 0
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190720 78047013 1 O2N6H24C29 A2B6C24D29 86.58 5.45 -9.03 -0.93 0
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190721 78047112 1 FON6H19C23 ABC6D19E23 29.76 6.15 -8.81 -0.74 0
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190722 78047452 1 O2N3C18H19 A2B3C18D19 5.11 10.22 -8.5 -1.56 0
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190723 78047453 2 ON3C14H15 AB3C14D15 40.61 8.95 -8.4 -1.43 0
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190724 78048185 2 NO2C8H11 AB2C8D11 -170.56 7.99 -8.55 -0.12 0
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190725 78048223 1 N2O4H20C21 A2B4C20D21 -109.5 5.91 -9.38 -1.22 0
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190726 78049263 4 NOC5H6 ABC5D6 -127.76 15.45 -8.62 -0.98 0
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190727 78049264 1 N2O3C18H20 A2B3C18D20 -75.39 10.18 -8.58 -1.28 0
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190728 78049476 1 N4O4C27H38 A4B4C27D38 -164.99 8.47 -8.62 -0.28 0
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190729 78049477 1 ClN4O4C19H21 AB4C4D19E21 -141.34 9.37 -8.64 -1.0 0
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190730 78049482 2 NO2C10H12 AB2C10D12 -121.27 8.46 -8.6 -1.43 0
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190731 78049483 1 ClN3O4C22H26 AB3C4D22E26 -160.38 13.31 -8.71 -1.11 0
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190732 78049706 1 SN5O9C18H29 AB5C9D18E29 -341.96 4.36 -9.55 -1.39 0
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190733 78049723 1 F2O2N5H17C22 A2B2C5D17E22 -41.85 4.04 -9.6 -1.76 0
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190734 78049749 1 N5O6C17H27 A5B6C17D27 -222.44 3.54 -9.81 -0.24 0
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190735 78049755 1 FO2N7H18C21 AB2C7D18E21 16.63 6.56 -10.02 -1.8 0
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190736 78050228 1 NO6C38H63 AB6C38D63 -337.04 5.57 -8.84 0.78 0
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190737 78050229 1 N2O6C25H28 A2B6C25D28 -213.83 7.37 -8.65 -0.2 0
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190738 78050230 1 SO2N3C16H17 AB2C3D16E17 -7.38 7.48 -9.25 -0.87 0
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190739 78050231 1 O2N5C22H23 A2B5C22D23 6.0 3.93 -8.84 -0.55 0
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190740 78050232 1 OSN3C17H19 ABC3D17E19 19.44 9.94 -8.86 -0.54 0
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190741 78050279 1 N4O15C41H74 A4B15C41D74 -802.26 6.19 -9.2 0.47 0
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190742 78050320 1 N7O10C22H43 A7B10C22D43 -436.46 6.25 -8.97 0.4 0
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190743 78050458 1 ClSiO3N6C25H33 ABC3D6E25F33 -76.1 4.99 -8.78 -1.13 0
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190744 78050611 2 NO3C20H34 AB3C20D34 -274.38 2.86 -8.74 1.19 0
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190745 78051219 1 NOC14H21 ABC14D21 -31.27 4.26 -8.98 0.22 0
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190746 78051751 1 N2O3C18H24 A2B3C18D24 -124.5 4.73 -8.26 0.22 0
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190747 78051829 1 ClN6O10C22H45 AB6C10D22E45 -511.89 5.47 -9.55 0.28 0
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190748 78051830 1 O2N3C18H27 A2B3C18D27 -54.81 3.06 -8.6 -0.28 0
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190749 78051831 1 O2N3C18H27 A2B3C18D27 -59.67 2.1 -8.49 -0.29 0
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190750 78051832 1 SO2N4C25H30 AB2C4D25E30 13.02 2.82 -8.43 -0.3 0
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190751 78051833 1 SN2O3C22H22 AB2C3D22E22 -45.33 6.28 -8.85 -0.74 0
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190752 78051978 2 N2O4C14H17 A2B4C14D17 -327.29 1.03 -9.51 0.02 0
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190753 78052244 1 SN4O4C33H50 AB4C4D33E50 -194.99 5.21 -8.44 -0.47 -1
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190754 78052408 1 PO10C40H78 AB10C40D78 -628.38 8.54 0.0 0.0 0
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190755 78052632 1 N2O20C27H46 A2B20C27D46 -921.48 2.69 -10.26 0.34 0
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190756 78052958 2 N2O27C37H62 A2B27C37D62 -2439.25 8.59 -9.95 0.13 0
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190757 78053004 1 N5O59C82H137 A5B59C82D137 -2689.67 10.98 -9.88 -0.13 0
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190758 78053181 1 N7O76C104H173 A7B76C104D173 -3448.23 9.4 -9.97 -0.19 0
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190759 78053360 1 N2O29C40H68 A2B29C40D68 -1331.29 11.98 -9.57 -0.31 0
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190760 78053361 1 N2O29C40H68 A2B29C40D68 -1323.95 4.19 -10.18 0.09 0
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190761 78053362 1 N2O29C40H68 A2B29C40D68 -1333.28 3.39 -10.17 0.11 0
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190762 78053363 1 N2O29C40H68 A2B29C40D68 -1326.8 6.57 -9.95 -0.4 0
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190763 78053364 1 N2O29C40H68 A2B29C40D68 -1337.68 2.87 -10.16 0.05 0
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190764 78053495 1 N3O31C42H71 A3B31C42D71 -1414.13 8.67 -10.02 0.04 0
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190765 78053496 1 N3O31C42H71 A3B31C42D71 -1409.05 2.46 -10.13 0.0 0
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190766 78053497 1 N3O31C42H71 A3B31C42D71 -1405.0 8.7 -10.14 0.08 0
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190767 78053755 1 ON2S2H10C13 AB2C2D10E13 52.71 5.26 -8.51 -1.35 0
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190768 78053756 1 SN2O2H12C14 AB2C2D12E14 14.4 3.09 -9.02 -0.97 0