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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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137137 52157828 2 NO3C14H15 AB3C14D15 -146.19 7.45 -8.89 -0.97 0
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137138 52157934 1 O3N4C16H18 A3B4C16D18 -57.89 7.86 -9.27 -0.76 -1
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137139 52157987 1 N2O5C15H17 A2B5C15D17 -180.96 5.51 0.0 0.0 0
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137140 52157988 1 N2O5C15H18 A2B5C15D18 -200.22 6.14 -9.12 -0.65 0
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137141 52158053 1 N3O3H13C17 A3B3C13D17 -36.93 2.46 -9.17 -0.95 0
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137142 52158144 1 SN2O5C18H18 AB2C5D18E18 -169.23 3.2 -8.92 -0.85 0
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137143 52158768 1 FO3N4C23H23 AB3C4D23E23 -97.68 1.59 -8.63 -0.46 0
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137144 52158844 1 O3N4C20H20 A3B4C20D20 -47.98 8.24 -8.73 -0.62 0
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137145 52158910 1 ClO3N4H21C22 AB3C4D21E22 -45.49 7.32 -9.07 -0.68 0
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137146 52159502 1 ClO3N4C23H23 AB3C4D23E23 -58.31 6.06 -8.91 -0.87 0
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137147 52159562 1 ClSN4O4C17H17 ABC4D4E17F17 -108.72 6.07 -9.12 -1.17 0
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137148 52159563 1 ClSN4O4C17H17 ABC4D4E17F17 -108.8 6.77 -9.28 -1.1 0
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137149 52159582 1 ClO3N4H19C20 AB3C4D19E20 -55.41 4.25 -8.76 -0.66 0
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137150 52159583 1 ClO3N4H19C20 AB3C4D19E20 -52.45 5.36 -8.7 -0.98 0
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137151 52159584 1 ClO3N4H15C18 AB3C4D15E18 -43.76 3.34 -8.92 -1.04 0
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137152 52159585 1 ClO3N4H15C18 AB3C4D15E18 -45.9 2.68 -8.86 -1.06 0
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137153 52159586 1 ClO3N4C17H19 AB3C4D17E19 -78.43 4.17 -9.06 -1.06 0
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137154 52159609 1 ClN3O3H16C17 AB3C3D16E17 -77.26 4.06 -9.23 -0.92 0
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137155 52159796 1 ClN2O4H17C18 AB2C4D17E18 -131.62 3.86 -9.18 -0.88 0
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137156 52159950 1 Cl2N2O4H14C17 A2B2C4D14E17 -123.32 6.15 -8.6 -1.01 0
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137157 52160167 1 NO4H9C11 AB4C9D11 -121.91 5.71 -9.42 -1.4 0
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137158 52160699 1 N3O4C25H25 A3B4C25D25 -73.84 6.79 -9.18 -1.37 0
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137159 52162081 1 SN2O2C10H10 AB2C2D10E10 -65.96 1.67 -8.73 -0.64 0
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137160 52163332 1 NO2C17H23 AB2C17D23 -56.64 2.75 -8.7 -0.03 0
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137161 52163333 1 NO3C15H19 AB3C15D19 -75.47 3.6 -8.47 -0.04 0