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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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193794 78438798 1 O4N5C16H23 A4B5C16D23 -148.32 7.42 -9.62 -0.47 0
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193795 78438799 2 NOH9C10 ABC9D10 -27.14 4.76 -8.4 -0.63 -1
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193796 78438878 1 N3O6C9H14 A3B6C9D14 -212.0 21.63 0.0 0.0 1
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193797 78439769 1 NO3C16H26 AB3C16D26 -107.93 5.25 0.0 0.0 -1
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193798 78439952 1 N3O4H14C16 A3B4C14D16 6.0 7.36 0.0 0.0 -1
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193799 78439977 1 N2O5C13H13 A2B5C13D13 -82.27 21.56 0.0 0.0 1
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193800 78440195 1 N2O2Cl4C13H17 A2B2C4D13E17 -87.21 2.67 0.0 0.0 1
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193801 78440196 1 ON2Cl4C15H19 AB2C4D15E19 -43.74 4.99 0.0 0.0 1
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193802 78440197 1 ON2Cl3C13H16 AB2C3D13E16 -22.66 9.95 0.0 0.0 -2
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193803 78440468 1 SN2H4C6O6 AB2C4D6E6 -188.58 3.66 -10.35 -1.71 0
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193804 78440469 1 NO5C13H23 AB5C13D23 -235.41 4.08 -9.96 0.0 1
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193805 78440574 1 ON2C12H15 AB2C12D15 42.9 15.28 0.0 0.0 -1
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193806 78440930 1 SN2O5H13C17 AB2C5D13E17 -50.23 3.07 0.0 0.0 -1
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193807 78440931 1 SN2O6H13C17 AB2C6D13E17 -79.14 2.67 0.0 0.0 0
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193808 78441129 1 ClN2O5C17H21 AB2C5D17E21 -132.46 2.59 -9.33 -2.06 0
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193809 78441130 1 N2O5C24H32 A2B5C24D32 -215.06 6.07 -9.58 -1.57 0
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193810 78441131 1 NO5C20H23 AB5C20D23 -170.77 5.84 -9.47 -1.36 0
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193811 78441132 1 N2O3C18H22 A2B3C18D22 -86.16 3.37 -9.37 -1.49 0
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193812 78441133 1 N2O3C22H28 A2B3C22D28 -123.84 4.11 -9.54 -1.11 0
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193813 78441134 1 N2O4C19H28 A2B4C19D28 -193.61 1.83 -9.37 -0.38 0
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193814 78441135 1 SO2N4C22H32 AB2C4D22E32 -50.38 3.77 -8.46 -0.09 -1
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193815 78441254 1 NO5H18C19 AB5C18D19 -157.5 4.46 0.0 0.0 0
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193816 78441704 1 SN4O4C25H32 AB4C4D25E32 -134.06 6.52 -8.38 -0.32 2
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193817 78441705 1 SO3N4C24H34 AB3C4D24E34 -33.38 10.76 -5.45 -0.17 -1
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193818 78442694 1 NO2H18C22 AB2C18D22 50.41 9.27 0.0 0.0 1