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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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32176 6435754 2 SN3O3H6C8 AB3C3D6E8 -47.85 6.03 -9.52 -1.77 0
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32177 6435756 1 NO12C44H69 AB12C44D69 -552.54 0.87 -9.53 -0.92 0
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32178 6435767 1 O2C17H22 A2B17C22 19.7 1.77 -8.94 -0.67 0
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32179 6435769 1 ClN2O2H13C17 AB2C2D13E17 -22.14 2.15 -9.4 -0.9 0
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32180 6435771 1 ClN2O2H13C17 AB2C2D13E17 -27.52 5.0 -9.15 -1.19 0
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32181 6435774 1 ClN2O2H13C17 AB2C2D13E17 -28.38 5.34 -9.36 -1.16 0
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32182 6435783 1 O3C27H40 A3B27C40 -120.9 1.72 -8.65 0.19 0
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32183 6435784 2 O3N4H8C9 A3B4C8D9 -27.01 3.53 -9.11 -1.9 0
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32184 6435791 1 SN3O7C11H11 AB3C7D11E11 -136.46 2.68 -10.0 -2.17 0
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32185 6435792 1 SN2O6C12H14 AB2C6D12E14 -179.07 6.6 -9.57 -1.15 0
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32186 6435794 1 S2N3O7C11H13 A2B3C7D11E13 -207.45 2.97 -10.26 -1.54 0
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32187 6435795 1 SN2O5C11H12 AB2C5D11E12 -144.68 5.46 -10.01 -1.41 0
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32188 6435801 1 PN2O5C8H15 AB2C5D8E15 -245.33 4.87 -9.6 -0.05 2
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32189 6435803 2 NOC12H18 ABC12D18 116.51 1.82 -2.09 -1.02 0
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32190 6435806 1 ClN2O6C23H29 AB2C6D23E29 -254.7 11.46 -8.81 -1.98 0
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32191 6435808 1 FN3O4C10H12 AB3C4D10E12 -178.4 5.33 -9.74 -0.52 0
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32192 6435810 1 O3C30H46 A3B30C46 -146.14 1.12 -8.6 0.2 0
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32193 6435811 1 ClON2C8H15 ABC2D8E15 -24.52 3.14 -8.9 -0.07 0
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32194 6435812 1 ON2C8H14 AB2C8D14 10.16 1.11 -8.72 0.21 0
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32195 6435845 1 ClN4O6C13H17 AB4C6D13E17 -136.97 9.36 -9.97 -2.28 0
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32196 6435861 2 OC6H11 AB6C11 -119.0 2.02 -10.59 -0.1 0
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32197 6435862 1 O2N3C22H45 A2B3C22D45 -129.87 5.15 -9.04 0.57 0
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32198 6435863 1 O5C21H42 A5B21C42 -293.17 4.92 -9.6 0.69 0
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32199 6435867 1 SO6C22H42 AB6C22D42 -326.94 1.35 -9.52 -0.77 0
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32200 6435873 1 NCl2O2C28H47 AB2C2D28E47 -141.91 2.63 -8.59 -0.67 0
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32202 6435903 2 OC6H11 AB6C11 -117.06 1.62 -9.44 0.84 0
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32203 6435906 1 SNa2O6C18H32 AB2C6D18E32 -428.21 16.23 -8.68 0.29 0
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32204 6435912 4 O2C15H27 A2B15C27 -523.11 0.65 -9.4 0.31 0
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32205 6435917 4 OC4H7 AB4C7 -224.82 5.33 -9.65 -0.32 0
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32206 6435920 2 OC7H12 AB7C12 -115.35 4.7 -10.18 0.58 0
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32207 6435924 1 SN4O10C24H28 AB4C10D24E28 -354.85 7.36 -9.14 -0.84 0
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32208 6435932 1 O2N3H19C23 A2B3C19D23 44.36 3.89 -8.73 -1.01 0
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32209 6435934 1 N2O2H14C17 A2B2C14D17 7.96 6.21 -8.71 -1.18 0
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32210 6435936 1 IN3O3H16C23 AB3C3D16E23 38.39 3.42 -8.91 -1.38 0
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32211 6435938 1 OSN6H18C21 ABC6D18E21 127.23 4.12 -9.26 -1.45 0
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32212 6435940 1 IO2N4H17C21 AB2C4D17E21 53.33 2.67 -9.27 -1.32 0
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32213 6435942 1 ClSN4O5C25H27 ABC4D5E25F27 -152.53 6.67 -8.48 -1.49 0
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32214 6435944 1 Cl2N2O3H18C24 A2B2C3D18E24 -44.8 2.32 -8.84 -1.37 0
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32215 6435946 1 OSN5H23C31 ABC5D23E31 152.13 5.03 -8.23 -1.56 0
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32216 6435948 2 N2O2H8C11 A2B2C8D11 36.19 6.13 -8.89 -1.83 0
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32217 6435953 1 O3N4H14C21 A3B4C14D21 77.69 5.2 -9.36 -1.9 0
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32218 6435956 1 ClON3H22C31 ABC3D22E31 86.61 5.24 -8.58 -0.96 0
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32219 6435958 1 BrOCl2N3H18C30 ABC2D3E18F30 89.73 6.69 -8.76 -1.24 0
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32220 6435964 1 IN4O4H21C23 AB4C4D21E23 -22.51 4.01 -8.4 -1.24 0
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32221 6435975 1 BrClON3H19C30 ABCD3E19F30 99.87 7.23 -8.68 -1.22 0
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32222 6435979 1 BrN4O4H17C23 AB4C4D17E23 41.23 7.18 -9.07 -1.51 0
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32223 6435981 1 N2O3H20C24 A2B3C20D24 -32.98 2.78 -8.46 -0.88 0
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32224 6435983 2 N2O2H10C11 A2B2C10D11 -36.08 3.46 -8.37 -1.24 0
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32225 6435989 1 BrON3H20C30 ABC3D20E30 109.38 7.72 -8.57 -1.1 0
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32226 6435993 1 Cl2N4C9H16 A2B4C9D16 22.78 8.21 -8.68 -0.45 2
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32227 6435995 2 N4C8H15 A4B8C15 84.52 0.02 -9.29 0.36 0
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32228 6436010 1 NO3C32H45 AB3C32D45 -96.45 4.05 -8.92 -0.4 0
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32229 6436029 2 OC9H16 AB9C16 -125.69 1.71 -9.33 0.82 0
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32230 6436032 1 N2O2C27H40 A2B2C27D40 -52.25 3.38 -8.44 -0.19 2
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32231 6436035 2 ON2C22H25 AB2C22D25 271.44 13.49 -4.95 -0.79 0
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32232 6436038 1 O35C57H94 A35B57C94 -1574.44 8.14 -10.23 -0.36 0
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32233 6436046 1 O6C21H34 A6B21C34 -287.3 6.62 -9.43 0.23 0
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32234 6436049 1 SO2C17H18 AB2C17D18 -48.85 7.01 -9.26 -0.65 0
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32235 6436053 1 ClSN2O4C25H25 ABC2D4E25F25 -104.83 2.01 -9.12 -1.02 0
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32236 6436055 1 S2N5O6C17H19 A2B5C6D17E19 -178.97 4.29 -9.04 -0.89 0
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32237 6436056 1 O5C23H40 A5B23C40 -274.27 2.2 -9.97 0.35 0
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32238 6436070 1 O3C38H54 A3B38C54 -143.92 2.45 -8.76 0.26 0
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32239 6436072 1 S3N4O11H16C24 A3B4C11D16E24 -206.48 3.04 -9.64 -2.03 0
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32240 6436099 1 N2O9C29H36 A2B9C29D36 -288.27 6.53 -8.85 -0.53 0
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32241 6436115 1 N5O6C13H15 A5B6C13D15 -79.3 5.61 -9.3 -1.37 0
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32242 6436116 1 C23H28 A23B28 10.39 1.48 -8.81 0.26 0
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32243 6436129 1 ClN2O4C22H25 AB2C4D22E25 -111.56 6.25 -8.52 -1.61 0
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32244 6436135 1 SN2O3C23H28 AB2C3D23E28 -87.54 4.15 -8.8 -0.8 0
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32245 6436136 1 FNC18H38 ABC18D38 -123.52 2.08 -9.23 1.46 0
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32246 6436148 1 NO7C31H37 AB7C31D37 -255.8 4.83 -9.8 -1.11 0
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32247 6436156 2 NO3C10H14 AB3C10D14 -208.4 1.28 -8.69 -0.26 0
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32248 6436157 1 O5C41H56 A5B41C56 -231.26 4.55 -8.81 -0.14 0
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32249 6436158 1 NO15C41H67 AB15C41D67 -705.45 9.8 -8.92 0.11 0
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32250 6436159 1 O5C12H14 A5B12C14 -169.08 4.83 -8.91 -0.92 0
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32251 6436160 1 O14C47H70 A14B47C70 -617.52 3.87 -9.38 0.37 0