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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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182157 76853832 1 FCl2N2C11H15 AB2C2D11E15 -71.52 1.53 -8.51 -0.18 0
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182158 76854509 1 SO2N3C20H27 AB2C3D20E27 -65.5 6.72 -8.55 -0.17 0
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182159 76854626 1 FSO2N5C24H26 ABC2D5E24F26 -50.14 4.46 -8.91 -0.85 0
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182160 76854627 1 SO2N5C26H31 AB2C5D26E31 -14.85 6.64 -8.7 -0.79 0
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182161 76854686 1 OSN4C20H28 ABC4D20E28 -13.73 2.05 -8.5 -0.03 0
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182162 76854687 1 FOS2N5C24H28 ABC2D5E24F28 -3.0 6.3 -8.34 -0.67 0
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182163 76854829 1 SN3O3H23C24 AB3C3D23E24 -28.61 4.69 -9.14 -1.2 0
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182164 76855034 1 N3O3C17H21 A3B3C17D21 -84.69 2.96 -9.48 -0.59 0
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182165 76855089 1 S2O3N4C22H26 A2B3C4D22E26 -58.65 4.03 -8.58 -0.61 0
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182166 76855568 1 ClSN3O3H22C25 ABC3D3E22F25 -56.44 9.17 -9.6 -1.76 0
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182167 76856085 1 ClNF3O3H13C16 ABC3D3E13F16 -185.22 4.15 -9.03 -0.76 0
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182168 76856173 1 ClNOSH10C12 ABCDE10F12 50.46 1.7 -9.17 -0.7 0
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182169 76856174 1 FNSO2H12C13 ABCD2E12F13 -26.4 2.6 -9.01 -0.85 0
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182170 76856175 1 SN2O2F3H13C16 AB2C2D3E13F16 -135.45 3.72 -9.29 -0.8 0
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182171 76856176 1 ClF2N2O2H11C15 AB2C2D2E11F15 -87.32 5.13 -9.26 -0.93 0
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182172 76856177 1 FN2O3H17C21 AB2C3D17E21 -36.72 3.32 -9.0 -0.76 0
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182173 76856178 1 FN2O3C17H17 AB2C3D17E17 -77.28 4.81 -8.86 -0.75 0
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182174 76856179 1 SN2O2C15H16 AB2C2D15E16 12.48 3.87 -9.4 -0.91 0
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182175 76856180 1 ClFNOSH9C12 ABCDEF9G12 3.92 1.48 -9.17 -0.7 0
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182176 76856311 1 IO2N3H14C17 AB2C3D14E17 24.91 5.18 -9.11 -1.71 0
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182177 76856312 1 Cl2N2O3C20H20 A2B2C3D20E20 -91.81 5.77 -9.04 -0.69 0
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182178 76856313 1 IOSN2H11C16 ABCD2E11F16 65.18 5.13 -9.13 -1.6 1
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182180 76856383 1 NO3C18H25 AB3C18D25 -126.64 2.93 -9.81 -1.06 0
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182181 76856384 1 SO2N3H17C18 AB2C3D17E18 10.02 3.08 -8.06 -0.69 0
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182182 76856385 1 ClSO2N4H17C18 ABC2D4E17F18 -1.28 9.13 -8.24 -1.0 0
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182183 76856386 1 O2S2N4C21H24 A2B2C4D21E24 -9.16 7.2 -8.51 -0.65 0
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182184 76856387 1 SO2N3C13H15 AB2C3D13E15 -22.54 2.41 -8.1 -0.39 0
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182185 76856388 1 O2N3H19C23 A2B3C19D23 31.88 1.89 -8.81 -1.42 0
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182186 76856389 1 SN4O4C26H30 AB4C4D26E30 -107.1 3.6 -9.4 -2.0 0
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182187 76856390 1 ClN4O4C21H23 AB4C4D21E23 -43.31 2.78 -9.26 -1.9 0
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182188 76856391 1 SO2N5C23H25 AB2C5D23E25 23.77 1.88 -8.22 -1.3 0
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182189 76856392 1 SO3N4C21H28 AB3C4D21E28 -72.26 10.51 -8.94 -0.64 0
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182190 76856393 1 ClS2N3O3H18C20 AB2C3D3E18F20 -38.45 5.88 -9.16 -1.67 0
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182191 76856394 2 ON2H7C9 AB2C7D9 101.79 6.66 -9.37 -1.78 0
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182192 76856615 1 N2O3C19H26 A2B3C19D26 -104.22 7.85 -8.77 -0.85 0
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182193 76856616 1 FSN2O4C20H21 ABC2D4E20F21 -151.43 3.57 -9.36 -1.2 0
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182194 76856712 1 SO2N4C27H32 AB2C4D27E32 -40.92 2.59 -8.38 -0.58 0
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182195 76857184 1 SN2O2F3H11C15 AB2C2D3E11F15 -146.05 1.95 -9.38 -1.11 0
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182196 76857185 1 BrNSO4C15H18 ABCD4E15F18 -141.15 4.16 -9.13 -0.83 0
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182197 76857306 2 ON2C10H13 AB2C10D13 -38.78 7.93 -8.44 -0.39 0
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182198 76857307 1 N2O3C19H22 A2B3C19D22 -77.68 6.24 -8.56 -0.94 0
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182199 76857308 1 O3N4C23H26 A3B4C23D26 -52.38 4.25 -8.64 -1.57 0
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182200 76857309 1 SO2N3H21C22 AB2C3D21E22 -6.63 3.18 -9.03 -1.43 0
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182201 76857310 1 N2O2C23H28 A2B2C23D28 -55.32 6.58 -8.53 -0.8 0
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182202 76857686 1 SO3N5C25H33 AB3C5D25E33 -53.85 3.43 -8.62 -0.62 0
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182203 76858041 1 O4N5C27H37 A4B5C27D37 -125.31 8.52 -9.3 -0.28 0
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182204 76858494 1 BrN4O4C17H17 AB4C4D17E17 -86.89 4.33 -9.72 -1.29 0
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182205 76858495 1 N5O5C21H21 A5B5C21D21 -60.63 6.83 -9.54 -1.95 0
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182206 76858780 1 SN4O4C19H30 AB4C4D19E30 -172.41 7.67 -9.13 -0.5 0
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182207 76859074 1 ClSN3O5H12C18 ABC3D5E12F18 -20.77 2.29 -9.08 -2.12 0