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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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165291 74527555 1 NO2S2C16H19 AB2C2D16E19 -46.95 3.43 -8.85 -1.37 0
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165292 74527624 1 ClNO2S2H10C12 ABC2D2E10F12 -30.94 5.1 -9.34 -1.9 0
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165293 74527881 1 SN2O4H14C19 AB2C4D14E19 -73.69 3.5 -9.4 -1.52 0
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165294 74528789 1 ClN2S3O6H15C19 AB2C3D6E15F19 -133.12 8.29 -9.23 -1.79 0
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165295 74528790 1 NS2O4H17C20 AB2C4D17E20 -78.96 1.11 -8.94 -1.58 0
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165296 74528791 1 NSO5H17C20 ABC5D17E20 -144.23 0.89 -9.23 -1.31 0
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165297 74528792 1 ClNSO5H16C20 ABCD5E16F20 -155.07 3.14 -9.3 -1.45 0
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165298 74528979 1 SN2O6H20C21 AB2C6D20E21 -146.28 6.98 -8.44 -1.16 0
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165299 74529049 1 N2S2O7H18C21 A2B2C7D18E21 -160.16 7.03 -9.31 -1.7 0
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165300 74529050 1 FN2S2O6H15C20 AB2C2D6E15F20 -163.4 6.75 -9.07 -1.83 0
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165301 74529051 1 ClN2S2O6H15C20 AB2C2D6E15F20 -124.81 1.41 -9.19 -1.84 0
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165302 74529052 1 FN2S2O6H15C20 AB2C2D6E15F20 -163.29 4.18 -9.22 -1.91 0
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165303 74529239 1 ClSN2F3O5H16C21 ABC2D3E5F16G21 -280.83 11.12 -9.34 -1.74 0
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165304 74529507 1 SN2O6H16C20 AB2C6D16E20 -191.03 6.54 -9.09 -1.34 0
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165305 74529513 1 SN2O5H18C21 AB2C5D18E21 -155.73 5.73 -9.16 -1.63 0
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165306 74529514 1 SN2O4C22H22 AB2C4D22E22 -109.21 4.12 -9.28 -1.2 0
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165307 74529521 1 ClSN2O4H15C19 ABC2D4E15F19 -112.22 4.1 -8.87 -1.35 0
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165308 74530026 1 N2S2O5C20H24 A2B2C5D20E24 -104.4 5.12 -9.4 -2.22 0
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165309 74530065 1 SN2O5H16C20 AB2C5D16E20 -114.01 5.96 -8.93 -1.37 0
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165310 74530153 1 ClSN2O4H15C20 ABC2D4E15F20 -79.21 7.41 -9.6 -1.45 0
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165311 74530305 1 SN3O7H15C19 AB3C7D15E19 -141.79 8.16 -9.94 -1.74 0
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165312 74530306 1 SN2O4H18C23 AB2C4D18E23 -76.36 8.36 -9.28 -1.23 0
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165313 74530307 1 SN3O4H15C18 AB3C4D15E18 -81.85 8.18 -9.56 -1.57 0
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165314 74530308 1 SN3O4H15C18 AB3C4D15E18 -82.27 6.63 -9.63 -1.39 0
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165315 74530721 1 SN2O4H16C19 AB2C4D16E19 -95.53 6.58 -9.01 -1.35 0
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165316 74531550 1 SN2O4H16C18 AB2C4D16E18 -80.87 2.8 -8.78 -1.08 0
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165317 74531648 1 SN2O3H18C19 AB2C3D18E19 -41.42 3.55 -8.93 -0.95 0
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165318 74531649 1 SN2O3H18C19 AB2C3D18E19 -43.74 6.28 -8.76 -1.16 0
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165319 74531734 1 N4O4C15H18 A4B4C15D18 -90.68 7.79 -9.58 -1.44 0
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165320 74531735 1 OSCl2N4H16C18 ABC2D4E16F18 37.46 6.33 -9.34 -1.19 1
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165321 74531736 1 FO3N4C24H24 AB3C4D24E24 -39.96 4.06 0.0 0.0 0
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165322 74532007 1 SO2N4H14C15 AB2C4D14E15 29.99 5.98 -9.86 -1.84 0
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165323 74532313 1 O2N5C19H25 A2B5C19D25 -10.65 4.39 -9.45 -1.82 0
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165324 74532314 1 O2N5C21H29 A2B5C21D29 -57.66 5.64 -9.3 0.02 0
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165325 74532315 1 O3N5C22H25 A3B5C22D25 -13.43 6.57 -8.97 -1.8 -1
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165326 74532502 1 SN3O3C12H14 AB3C3D12E14 -57.77 6.65 0.0 0.0 -1
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165327 74532651 1 N4O5C24H27 A4B5C24D27 -179.0 6.94 0.0 0.0 1
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165328 74532907 1 FO2N4H24C28 AB2C4D24E28 23.98 4.75 0.0 0.0 0
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165329 74533086 1 ON3C22H25 AB3C22D25 15.61 5.67 -8.16 0.12 0
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165330 74533280 1 ClSF2N2O5H17C21 ABC2D2E5F17G21 -251.38 5.55 -9.14 -1.52 0
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165331 74533344 1 SN3O3H21C23 AB3C3D21E23 -57.81 4.21 -8.57 -1.19 -1
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165332 74534096 1 SN2O5C20H27 AB2C5D20E27 -190.41 4.8 0.0 0.0 -1
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165333 74534370 1 SN2O4C23H31 AB2C4D23E31 -183.15 4.34 0.0 0.0 -1
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165334 74534457 1 N3O7H20C22 A3B7C20D22 -116.34 9.34 0.0 0.0 1
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165335 74534613 1 ClO3N4H18C20 AB3C4D18E20 -19.83 2.85 0.0 0.0 0
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165336 74534614 1 N3O6H23C24 A3B6C23D24 -187.65 3.29 -8.82 -0.78 -1
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165337 74534707 1 N2O6C15H15 A2B6C15D15 -100.5 4.9 0.0 0.0 0
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165338 74534807 1 O2N7C28H29 A2B7C28D29 40.36 8.57 -8.73 -1.22 0
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165339 74534808 1 O4N7C26H31 A4B7C26D31 -42.15 4.92 -8.51 -0.78 0
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165340 74534809 1 ClO2N7C24H26 AB2C7D24E26 15.42 8.28 -8.71 -1.11 0