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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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412179 135085053 1 OSC8H8 ABC8D8 6.21 0.54 -9.29 -0.69 0
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412182 135085056 1 ClON3C27H28 ABC3D27E28 66.85 11.74 -7.87 -1.53 0
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412184 135085059 1 FeN2C26H40 AB2C26D40 199.97 7.58 -7.37 -0.94 0
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412185 135085060 2 BrNOSC14H17 ABCDE14F17 -49.92 15.8 -8.6 -0.98 -1
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412186 135085061 1 NOH14C15 ABC14D15 46.79 0.31 0.0 0.0 0
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412187 135085062 1 NOC15H15 ABC15D15 27.39 6.22 -8.2 -0.43 0
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412188 135085063 1 PdCl2N2C36H36 AB2C2D36E36 199.51 3.94 -7.21 -0.56 0
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412189 135085064 2 NC18H18 AB18C18 123.54 0.54 -9.13 0.21 -2
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412190 135085065 1 IrSN2O2C15H16 ABC2D2E15F16 176.51 28.4 0.0 0.0 0
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412191 135085066 1 N3O3C29H41 A3B3C29D41 -109.32 1.14 -9.14 -0.34 0
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412192 135085067 1 NVO6C23H41 ABC6D23E41 -304.85 8.44 0.0 0.0 0
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412193 135085068 1 NO3C21H33 AB3C21D33 -157.84 3.72 -8.43 -0.88 0
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412194 135085069 1 ScO2N3H19C25 AB2C3D19E25 125.4 4.62 0.0 0.0 0
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412195 135085070 1 ClNORuC15H17 ABCDE15F17 119.34 5.78 0.0 0.0 0
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412197 135085072 1 N3O3C28H39 A3B3C28D39 -105.31 4.45 -9.23 -0.63 2
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412198 135085073 1 N7O7C36H45 A7B7C36D45 -251.29 10.71 -8.98 0.17 1
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412199 135085074 1 N7O7C36H44 A7B7C36D44 -186.24 5.1 0.0 0.0 -1
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412200 135085075 1 NORh2C6H12 ABC2D6E12 1.55 17.36 0.0 0.0 -4
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412202 135085077 1 TiN2C18H19 AB2C18D19 123.23 5.47 0.0 0.0 0
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412203 135085078 1 NCl3O4C13H14 AB3C4D13E14 -185.84 2.69 -10.13 -0.74 0
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412204 135085079 1 NCl3O4C16H20 AB3C4D16E20 -198.52 4.0 -9.78 -0.45 0
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412205 135085080 1 NCl3O4C18H24 AB3C4D18E24 -205.63 3.22 -9.77 -0.41 0
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412206 135085081 1 NCl3O5C22H32 AB3C5D22E32 -274.51 9.18 -8.92 -0.56 0
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412207 135085082 1 N2O2C85H88 A2B2C85D88 53.35 2.7 -8.41 0.29 0
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412208 135085091 2 PPdO2C23H25 ABC2D23E25 61.7 10.52 -6.2 -1.74 0