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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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124922 50903572 1 N2S2O3H16C17 A2B2C3D16E17 -3.19 8.28 -8.87 -1.41 1
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124923 50903737 1 N4O6C30H31 A4B6C30D31 -166.89 2.36 0.0 0.0 0
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124924 50903891 2 N2O2C15H15 A2B2C15D15 -108.42 5.21 -8.92 -0.47 1
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124925 50903963 1 N3O3C30H32 A3B3C30D32 -27.32 6.47 0.0 0.0 1
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124926 50904078 1 O2N4C22H25 A2B4C22D25 -15.37 6.74 0.0 0.0 0
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124927 50904217 1 NSO5H19C24 ABC5D19E24 -95.15 3.43 -9.58 -1.14 0
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124928 50904253 1 NC17H27 AB17C27 27.48 1.35 -8.51 1.8 0
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124929 50904389 1 NS2O3C19H21 AB2C3D19E21 -86.93 6.94 -8.63 -0.52 0
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124930 50904390 1 NSO9C20H21 ABC9D20E21 -247.37 1.96 -10.14 -2.18 0
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124931 50904391 2 ClNOC12H13 ABCD12E13 -80.52 6.31 -9.03 -0.89 -1
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124932 50904392 1 NO5C18H22 AB5C18D22 -159.09 5.16 0.0 0.0 0
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124933 50904665 1 NO2H17C21 AB2C17D21 3.04 2.47 -8.88 -0.56 0
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124934 50904705 1 NOSC18H25 ABCD18E25 -48.45 4.81 -8.85 -0.41 0
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124935 50904707 1 Br2O2C13H14 A2B2C13D14 -64.21 1.61 -10.1 -0.7 0
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124936 50904763 1 SN2O6C23H32 AB2C6D23E32 -242.57 9.23 -9.37 -1.25 0
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124937 50904799 1 SN2O3C23H28 AB2C3D23E28 -95.68 5.0 -8.8 -0.95 0
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124938 50904843 1 NF2O4C24H27 AB2C4D24E27 -244.54 5.21 -8.93 -0.78 0
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124939 50904883 1 Cl2N7O18H43C58 A2B7C18D43E58 -494.8 9.84 -9.22 -2.1 0
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124940 50904884 1 NO6C8H13 AB6C8D13 -262.01 3.0 -9.09 0.22 0
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124941 50904885 2 O8C9H16 A8B9C16 -654.58 1.02 -10.41 -0.75 0
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124942 50904886 1 ClSN3O3H12C15 ABC3D3E12F15 -31.97 6.2 -9.02 -1.61 0
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124943 50904977 1 NO2C20H31 AB2C20D31 -101.95 3.0 -8.83 0.39 1
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124944 50904981 1 FON3C22H33 ABC3D22E33 -70.82 2.36 0.0 0.0 0
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124945 50904982 1 FON3C22H32 ABC3D22E32 -89.57 5.49 -8.27 0.06 0
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124946 50904983 1 ClNO3H18C24 ABC3D18E24 -29.24 3.38 -9.59 -0.82 0