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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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44144 10501162 1 N2O3H24C25 A2B3C24D25 -52.86 2.39 -8.36 -0.4 0
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44145 10501163 1 F3O3C22H31 A3B3C22D31 -285.27 2.24 -9.99 -0.39 0
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44146 10501168 1 O7C21H36 A7B21C36 -349.9 2.76 -9.65 1.38 0
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44147 10501170 1 N2O4C23H32 A2B4C23D32 -126.65 1.49 -9.31 -0.88 0
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44148 10501172 1 ON4C25H28 AB4C25D28 67.68 6.61 -9.06 -0.32 0
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44149 10501208 1 BrSN2C20H21 ABC2D20E21 49.68 7.47 -8.68 -0.6 0
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44150 10501209 1 N3O7C19H19 A3B7C19D19 -231.21 6.64 -9.74 -1.52 0
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44151 10501211 1 BrO3C20H33 AB3C20D33 -178.98 3.04 -9.6 -0.04 0
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44152 10501212 1 NSF3O4C18H18 ABC3D4E18F18 -300.08 5.43 -8.46 -0.62 0
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44153 10501213 1 NF2S2O5H13C16 AB2C2D5E13F16 -256.72 5.95 -9.61 -1.03 0
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44154 10501214 1 NO7C21H23 AB7C21D23 -154.32 7.31 -8.71 -0.55 0
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44155 10501215 1 NO7C21H23 AB7C21D23 -205.35 2.74 -8.24 -0.2 0
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44156 10501216 1 N3O4H19C23 A3B4C19D23 -14.29 8.17 -8.69 -1.84 2
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44157 10501219 1 FeNOSiC21H35 ABCDE21F35 -102.56 2.47 -8.34 0.15 0
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44158 10501222 1 NO6C22H27 AB6C22D27 -231.86 5.1 -9.64 -0.05 0
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44159 10501223 1 NO4H23C25 AB4C23D25 -87.68 3.57 -9.55 -0.34 0
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44160 10501224 1 NO4H23C25 AB4C23D25 -53.18 2.09 -9.49 -0.6 0
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44161 10501229 1 O4N5C20H27 A4B5C20D27 -152.64 7.63 -8.9 -0.59 0
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44162 10501230 1 O3N7C19H27 A3B7C19D27 -81.33 8.0 -9.27 -1.16 0
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44163 10501231 1 ON7C22H23 AB7C22D23 105.12 7.95 -9.55 -0.62 0
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44164 10501248 1 NO2C27H31 AB2C27D31 -24.79 2.38 -9.43 0.08 0
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44165 10501253 1 OS2N3C21H27 AB2C3D21E27 22.54 4.62 -8.83 -0.16 0
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44166 10501255 1 NSi2O4C19H39 AB2C4D19E39 -319.56 2.84 -8.99 0.43 0
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44167 10501256 1 ClO3N5C19H20 AB3C5D19E20 -57.87 4.31 -9.36 -1.05 0
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44168 10501258 1 ClNO2C24H32 ABC2D24E32 -106.19 4.59 -9.26 -0.33 0
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44169 10501269 1 N2O5H18C23 A2B5C18D23 -130.59 12.99 -9.38 -1.98 0
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44170 10501272 1 PO5C22H27 AB5C22D27 -196.12 1.59 -8.51 0.21 0
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44171 10501284 1 O4N6C19H26 A4B6C19D26 -120.34 4.29 -8.95 -0.59 2
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44173 10501316 1 OSiC26H46 ABC26D46 -147.63 2.05 -8.67 1.12 0
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44174 10501319 1 ClN2O5H19C20 AB2C5D19E20 -126.16 5.83 -9.29 -0.41 0
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44175 10501322 1 ClSO2N4C19H19 ABC2D4E19F19 29.89 2.34 -8.31 -1.18 0
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44176 10501325 1 INO5C14H14 ABC5D14E14 -182.87 4.72 -9.61 -1.48 0
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44177 10501362 1 NSO4C22H29 ABC4D22E29 -156.1 5.02 -8.5 -0.35 0
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44178 10501406 1 SN2O4C8H12 AB2C4D8E12 -123.46 2.22 -8.42 -0.23 1
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44179 10501438 1 OSN2F3H12C15 ABC2D3E12F15 -149.1 8.12 0.0 0.0 0
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44180 10501486 1 NO3C20H23 AB3C20D23 -79.06 4.09 -9.04 -0.44 -1
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44181 10501487 1 NF3O6C18H23 AB3C6D18E23 -374.11 19.48 0.0 0.0 0
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44182 10501500 1 O2N4H18C25 A2B4C18D25 92.43 3.86 -9.06 -1.29 0
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44183 10501602 2 NO2C12H14 AB2C12D14 -124.26 3.86 -8.71 -0.35 0
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44184 10501697 1 F6O6C15H20 A6B6C15D20 -602.24 4.75 -10.36 0.01 0
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44185 10501792 2 ON2C6H7 AB2C6D7 -23.24 6.26 -9.37 -0.69 0
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44186 10501793 1 ClF3N3O4C16H21 AB3C3D4E16F21 -276.11 5.77 -8.79 -1.57 0
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44187 10501794 1 ClF2N3O3C19H20 AB2C3D3E19F20 -165.68 11.72 -9.27 -1.45 0
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44188 10501795 1 ClOSeC21H29 ABCD21E29 -74.16 2.41 -8.54 -0.25 0
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44189 10501848 1 SSiN2O3C21H24 ABC2D3E21F24 -52.96 7.35 -7.77 -0.56 0
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44190 10501849 1 SiO6C21H36 AB6C21D36 -335.24 3.66 -9.03 0.14 0
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44191 10501855 1 N2O3C24H48 A2B3C24D48 -218.72 5.49 -9.12 0.28 0
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44192 10501870 1 NO7C22H23 AB7C22D23 -176.27 4.96 -9.62 -2.06 0
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44193 10501889 1 NSO4C23H27 ABC4D23E27 -132.53 5.71 -8.62 -0.64 0
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44194 10501892 1 NO2C28H31 AB2C28D31 -7.21 3.02 -8.14 -0.29 0
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44195 10501893 1 NO2C28H31 AB2C28D31 -11.87 1.6 -8.59 0.34 0
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44196 10501899 1 ClN3O3C22H24 AB3C3D22E24 -47.5 2.49 -8.88 -0.93 0
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44197 10501910 1 O10C19H26 A10B19C26 -423.9 4.14 -10.06 0.42 0
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44198 10501946 2 O2C13H19 A2B13C19 -193.84 2.68 -9.3 -0.01 0
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44199 10501947 1 S2O3C23H26 A2B3C23D26 -77.92 4.02 -8.39 -0.17 0
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44200 10501962 1 ClN2O4C22H23 AB2C4D22E23 -124.42 7.08 -8.47 -0.33 0
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44201 10501997 1 NO2Br3C10H10 AB2C3D10E10 9.27 4.89 -10.59 -1.54 0
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44202 10501998 1 ClSN5H14C22 ABC5D14E22 167.87 4.97 -8.62 -1.51 0
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44203 10502003 1 IO8C12H17 AB8C12D17 -358.28 2.19 -10.15 -1.46 0
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44204 10502016 1 N2O6H16C23 A2B6C16D23 -13.77 4.75 -9.47 -2.27 0
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44205 10502017 1 O10C19H28 A10B19C28 -458.18 2.97 -10.24 0.48 0
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44206 10502019 2 O4C11H12 A4B11C12 -303.66 4.82 -9.1 -2.01 0
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44207 10502023 1 O6H20C25 A6B20C25 -135.77 5.49 -8.98 -1.09 0
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44208 10502026 1 N4O4H20C23 A4B4C20D23 27.87 7.03 -8.83 -1.56 0
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44209 10502027 1 O2N8H20C21 A2B8C20D21 156.46 4.79 -8.84 -2.35 0
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44210 10502028 1 SO5H16C24 AB5C16D24 -75.25 6.73 -9.69 -1.22 0
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44211 10502029 1 SO4N6C18H20 AB4C6D18E20 -77.96 6.86 -9.05 -1.08 0
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44212 10502030 1 OSN8H16C20 ABC8D16E20 184.34 9.73 -8.68 -1.89 0
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44213 10502033 1 N2O4H24C25 A2B4C24D25 -74.35 3.07 -9.21 -0.75 0
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44214 10502034 1 O3N4C24H24 A3B4C24D24 -43.3 3.02 -8.33 -0.55 0
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44215 10502036 1 SO6C22H24 AB6C22D24 -175.24 4.34 -9.2 -0.22 0
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44216 10502041 2 O3C12H16 A3B12C16 -212.1 1.51 -8.64 -0.2 0
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44217 10502042 2 OH12C15 AB12C15 4.34 3.63 -8.59 -1.73 0
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44218 10502045 1 N2O6C21H40 A2B6C21D40 -338.04 3.82 -9.09 0.47 0
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44219 10502046 1 N2S2O5C18H28 A2B2C5D18E28 -174.87 7.64 -8.72 -0.49 0