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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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169066 75059470 18 CH2 AB2 -56.4 0.61 -9.41 1.48 0
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169067 75059658 1 OSC10H12 ABC10D12 1.22 1.41 -8.96 -0.4 0
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169068 75060061 1 F2N3O16C32H41 A2B3C16D32E41 -510.68 5.2 -9.98 -1.51 0
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169069 75060062 1 F2N3O20C41H49 A2B3C20D41E49 -637.09 9.79 -9.37 -1.67 0
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169070 75060086 1 BKNOF3C13H18 ABCDE3F13G18 -387.22 7.1 -8.55 0.25 -1
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169071 75060087 1 BNOF3C13H18 ABCD3E13F18 -298.92 4.28 0.0 0.0 0
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169072 75060104 1 FN3O14C32H42 AB3C14D32E42 -472.07 12.07 -9.79 -1.77 0
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169073 75060105 1 FN3O14C33H44 AB3C14D33E44 -478.52 9.52 -9.71 -1.1 0
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169074 75060106 1 FNO10C27H36 ABC10D27E36 -331.24 4.2 -8.9 -1.12 0
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169075 75060107 1 FN2O14C31H41 AB2C14D31E41 -472.11 7.9 -9.82 -1.23 0
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169076 75060579 1 ClN2O17C36H47 AB2C17D36E47 -582.46 9.81 -9.61 -1.25 0
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169077 75060662 2 SO3N5C29H35 AB3C5D29E35 -157.22 4.57 -8.81 -0.76 0
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169078 75061292 1 O31C63H102 A31B63C102 -1454.29 6.98 -9.51 0.05 0
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169079 75061293 1 O31C62H100 A31B62C100 -1436.75 6.9 -10.02 -0.15 0
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169080 75061294 1 O11C31H38 A11B31C38 -418.74 2.23 -9.87 -1.22 0
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169081 75061295 1 O32C63H102 A32B63C102 -1501.15 5.77 -9.88 -0.03 0
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169082 75061592 1 Cl2N3C18H21 A2B3C18D21 27.95 4.23 -8.27 -0.36 1
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169083 75061593 1 BrO3N4C10H12 AB3C4D10E12 -93.08 3.96 0.0 0.0 0
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169084 75061594 2 NO2C11H11 AB2C11D11 0.24 3.64 -8.9 -1.3 0
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169085 75061595 1 NO2C11H11 AB2C11D11 41.7 2.13 -8.72 -1.03 0
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169086 75061596 1 N2O7C16H16 A2B7C16D16 -88.73 10.74 -8.99 -1.91 0
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169087 75061716 1 NO5C32H39 AB5C32D39 -151.68 1.34 -8.44 -1.37 0
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169088 75061786 1 FN4O4H25C27 AB4C4D25E27 -72.13 8.34 -8.85 -0.72 0
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169089 75062084 1 ClO3N5C22H22 AB3C5D22E22 3.82 5.82 -8.71 -0.94 0
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169090 75062348 1 ClN4O4H27C28 AB4C4D27E28 -41.93 2.45 -9.06 -0.68 0
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169091 75062416 1 SN2O3H16C19 AB2C3D16E19 -34.62 3.1 -8.9 -1.2 0
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169092 75062489 1 ZnCl2S2N6H26C30 AB2C2D6E26F30 147.07 7.42 -8.93 -1.78 0
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169093 75062832 1 ClNO5H20C21 ABC5D20E21 -84.07 30.98 -6.75 -2.3 0
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169094 75062836 1 BrO4N5C12H14 AB4C5D12E14 -138.71 9.37 -9.17 -2.56 0
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169095 75063045 1 SN3F9O12H34C38 AB3C9D12E34F38 -909.58 14.88 -9.25 -2.99 1
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169096 75063300 1 N3O5C28H34 A3B5C28D34 -127.63 4.78 0.0 0.0 0
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169097 75063471 1 ClFOSN3C13H15 ABCDE3F13G15 -50.02 6.02 -9.37 -1.01 0
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169098 75063511 1 S2O4N5H13C15 A2B4C5D13E15 -73.62 2.93 -8.82 -2.04 0
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169099 75063512 1 ClSO2N5C14H16 ABC2D5E14F16 31.16 17.36 -7.09 -1.24 0
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169100 75063513 1 ClSO3N5C12H18 ABC3D5E12F18 -125.21 8.72 -9.93 -1.46 0
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169101 75063514 1 SO3N5C12H17 AB3C5D12E17 -83.55 5.84 -9.52 -0.97 0
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169102 75064032 1 ClN2O2H11C19 AB2C2D11E19 21.26 5.35 -9.2 -1.78 0
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169103 75064707 2 ClNSC16H16 ABCD16E16 98.01 10.85 -7.49 -0.9 0
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169104 75065095 1 PN5O7C11H14 AB5C7D11E14 -289.09 4.33 -9.38 -0.92 0
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169105 75065186 1 SO4N5H9C12 AB4C5D9E12 30.92 5.22 -9.66 -1.78 0
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169106 75065414 1 NO7C26H31 AB7C26D31 -223.85 4.82 -8.67 -0.84 0
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169107 75065495 1 ClFO2N9C18H19 ABC2D9E18F19 87.27 5.93 -9.38 -1.35 0
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169108 75065700 1 NO5H19C21 AB5C19D21 -32.08 2.6 -9.28 -1.83 0
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169109 75065701 1 O3H20C21 A3B20C21 -36.57 3.04 -9.04 -0.93 0
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169110 75065702 1 O3C22H22 A3B22C22 -35.56 2.19 -9.16 -0.83 0
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169111 75065703 1 O3C23H24 A3B23C24 -41.16 2.8 -9.21 -0.51 0
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169112 75065704 1 NO5C20H23 AB5C20D23 -79.15 3.99 -9.06 -0.96 0
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169113 75066088 1 SO2N4H10C13 AB2C4D10E13 30.32 6.47 -9.63 -1.55 0
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169114 75067005 1 O3C24H28 A3B24C28 -90.29 2.19 -8.66 -0.65 0
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169115 75067066 1 SSi3N5O7C40H69 AB3C5D7E40F69 -411.5 3.48 -8.42 -0.41 0