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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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187204 77543755 1 FN3O5C25H28 AB3C5D25E28 -192.29 5.82 -8.69 -0.64 0
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187205 77543764 1 SN3O5C35H49 AB3C5D35E49 -189.04 5.5 -9.15 -0.7 0
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187206 77543821 1 ClNOF3C9H11 ABCD3E9F11 -206.95 1.05 -10.41 -1.01 0
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187207 77543822 1 NOF3C9H10 ABC3D9E10 -170.11 1.91 -10.21 -0.86 0
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187208 77543823 1 SO5H48C50 AB5C48D50 -49.35 2.08 -8.63 -0.53 0
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187209 77543950 1 N2F3O3C21H25 A2B3C3D21E25 -258.22 3.7 -9.23 -0.44 0
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187210 77544343 1 ClF3N4C17H18 AB3C4D17E18 -99.52 7.65 -8.74 -0.43 0
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187211 77544775 1 F3N3C19H22 A3B3C19D22 -108.35 7.35 -8.34 -0.38 0
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187212 77545167 1 SN3O4C22H27 AB3C4D22E27 -154.72 10.87 -9.0 -1.22 0
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187213 77545168 1 Cl2N2O6C35H42 A2B2C6D35E42 -229.74 5.65 -8.75 -0.41 0
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187214 77545169 1 N2F3O3C26H43 A2B3C3D26E43 -320.97 6.16 -8.5 -0.34 0
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187215 77545170 1 Cl2N2O3C26H32 A2B2C3D26E32 -142.06 5.1 -9.4 -0.57 0
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187216 77545598 1 NCl2O3C16H19 AB2C3D16E19 -115.64 7.32 -9.4 -0.45 0
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187217 77545766 4 NOC8H10 ABC8D10 -120.17 3.7 -8.87 -0.73 0
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187218 77545767 4 NOC8H10 ABC8D10 -132.3 2.4 -7.9 -0.45 0
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187219 77545975 1 O2N3C16H21 A2B3C16D21 -42.09 0.92 -9.24 0.13 0
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187220 77545976 1 N3O5C27H31 A3B5C27D31 -168.74 9.07 -9.5 -0.9 0
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187221 77545977 1 O2N3C22H31 A2B3C22D31 -90.67 7.34 -8.8 -0.6 0
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187222 77545978 1 BrO2N6C21H25 AB2C6D21E25 -2.18 7.8 -9.32 -1.29 0
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187223 77545979 1 O2N4C19H24 A2B4C19D24 -41.41 1.89 -9.44 -1.45 0
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187224 77546641 1 ON5C20H25 AB5C20D25 78.2 6.68 -8.56 -0.65 0
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187225 77546980 1 S2O5N6C25H32 A2B5C6D25E32 -152.87 3.3 -8.95 -0.98 0
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187226 77547325 1 SF2O2N5C20H25 AB2C2D5E20F25 -86.21 5.21 -9.35 -0.57 0
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187227 77547329 1 SCl2N3O6H17C19 AB2C3D6E17F19 -189.06 8.72 -9.15 -0.94 0
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187228 77547446 1 SN2O2C22H28 AB2C2D22E28 -66.45 4.16 -8.46 -0.15 0
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187229 77547612 1 F2O11C46H60 A2B11C46D60 -589.12 17.72 -9.62 -0.78 0
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187230 77547613 1 FON2H19C24 ABC2D19E24 14.04 5.84 -9.63 -0.65 0
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187231 77547816 1 BrN3O3C23H34 AB3C3D23E34 -124.68 4.83 -8.51 -0.22 0
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187232 77548429 1 FSN3O7H20C22 ABC3D7E20F22 -207.61 7.67 -9.42 -1.18 0
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187233 77548430 1 F2N2O3C17H20 A2B2C3D17E20 -215.23 1.82 -9.49 -0.84 0
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187234 77548464 2 O3C14H21 A3B14C21 -279.18 4.11 -8.98 0.16 0
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187235 77548518 1 F2N2O3C18H26 A2B2C3D18E26 -261.71 6.42 -9.28 0.42 0
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187236 77548837 1 SiN3O7C37H45 AB3C7D37E45 -230.18 9.0 -8.86 -0.12 1
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187237 77548956 1 N3O4H24C29 A3B4C24D29 21.56 4.7 0.0 0.0 0
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187238 77548957 1 ClON2F3C19H20 ABC2D3E19F20 -182.22 5.84 -8.52 -0.91 0
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187239 77548958 1 SN3O5C27H33 AB3C5D27E33 -141.72 7.05 -8.54 -1.34 0
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187240 77548959 1 ClON2C19H23 ABC2D19E23 -21.44 4.39 -8.26 -0.29 0
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187241 77549433 1 SN2O4C22H32 AB2C4D22E32 -175.57 6.22 -8.93 -0.6 0
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187242 77549544 1 ClON2C19H23 ABC2D19E23 -24.35 4.71 -8.54 -0.07 0
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187243 77549545 1 OCl2N2C18H20 AB2C2D18E20 -23.57 3.67 -8.78 -0.43 0
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187244 77549548 1 NO3C20H21 AB3C20D21 -81.38 4.67 -9.0 -0.33 0
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187245 77549801 1 BrFNO2H15C17 ABCD2E15F17 -72.45 2.03 -8.96 -0.66 0
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187246 77550110 1 Cl2O2N7C21H29 A2B2C7D21E29 -80.16 7.34 -8.99 -1.1 -1
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187247 77550244 1 N3O12C35H48 A3B12C35D48 -369.75 3.71 0.0 0.0 1
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187248 77550587 1 FSN4O5C26H30 ABC4D5E26F30 -222.35 3.56 0.0 0.0 0
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187249 77551089 1 ClFN5O5C28H29 ABC5D5E28F29 -117.81 8.25 -9.09 -1.32 0
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187250 77551090 1 N3O3H29C31 A3B3C29D31 -13.39 5.88 -9.19 -0.48 0
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187251 77551091 1 NOC22H31 ABC22D31 -36.63 4.75 -8.19 0.73 0
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187252 77551092 1 FSN3O4C20H24 ABC3D4E20F24 -178.98 4.52 -8.59 -0.73 0
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187253 77551093 1 N5C23H23 A5B23C23 96.6 4.15 -8.14 -0.61 0