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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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185245 77275094 1 O2N6C25H40 A2B6C25D40 -90.51 5.32 -8.76 0.0 0
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185246 77275095 1 FO2N6C23H37 AB2C6D23E37 -139.73 4.77 -8.86 -0.21 0
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185247 77275096 1 N3O4C43H45 A3B4C43D45 -34.49 6.46 -8.56 -0.59 0
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185248 77275244 1 FSO2N5H22C24 ABC2D5E22F24 -3.82 4.77 -9.35 -1.22 0
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185249 77275245 1 F2O2N5H21C24 A2B2C5D21E24 -44.76 5.07 -9.5 -1.47 0
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185250 77275246 1 SF2O6C26H26 AB2C6D26E26 -290.28 6.9 -9.7 -1.3 0
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185251 77275333 1 O4N8C27H38 A4B8C27D38 -109.1 5.75 -8.53 -1.18 0
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185252 77276162 1 ClFN2O7C27H28 ABC2D7E27F28 -304.91 8.29 -9.24 -1.12 0
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185253 77276278 1 BrFO2N3H17C21 ABC2D3E17F21 -35.11 4.07 -9.21 -0.99 0
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185254 77276337 1 FN2O4C21H21 AB2C4D21E21 -146.51 1.49 -8.78 -0.64 0
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185255 77276543 1 BrN2C10H13 AB2C10D13 30.04 4.78 -8.84 -0.14 0
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185256 77277532 1 NOSC7H15 ABCD7E15 -41.91 3.26 -8.9 0.38 0
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185257 77277630 1 FON3C22H26 ABC3D22E26 -51.12 3.23 -8.98 -0.84 0
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185258 77277942 1 FS2N3O6H16C19 AB2C3D6E16F19 -177.16 7.13 -9.3 -1.35 0
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185259 77277999 1 ClN2O3C27H35 AB2C3D27E35 -112.0 4.62 -9.04 -0.61 0
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185260 77278039 1 ClO2N4C21H25 AB2C4D21E25 -31.76 4.24 -8.79 -0.66 0
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185261 77278111 1 LiNOH7C9 ABCD7E9 -17.09 3.44 0.0 0.0 0
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185262 77278112 1 SO5C16H18 AB5C16D18 -166.17 1.87 -8.68 -0.46 0
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185263 77278113 1 FSO2N4C22H23 ABC2D4E22F23 -38.29 3.38 -9.34 -0.7 0
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185264 77278264 1 N3O5C33H43 A3B5C33D43 -206.9 6.92 -8.7 0.1 0
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185265 77278265 1 ON5C24H27 AB5C24D27 44.2 2.81 -9.16 -0.63 0
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185266 77278501 1 FSO3N4C21H21 ABC3D4E21F21 -61.94 5.67 -8.71 -0.68 0
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185267 77278843 1 FSN6O7C35H41 ABC6D7E35F41 -251.5 13.29 -8.38 -0.81 0
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185268 77279296 1 OF2N3C26H29 AB2C3D26E29 -112.83 3.72 -8.68 -0.73 0
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185269 77279322 1 FON2C26H29 ABC2D26E29 -44.22 6.5 -8.43 -0.59 0
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185270 77279323 1 NO2C16H21 AB2C16D21 -88.92 5.48 -8.31 0.43 0
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185273 77279715 2 ON2C10H12 AB2C10D12 -10.13 5.02 -9.0 -0.29 0
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185274 77279716 1 ClO2N5C27H28 AB2C5D27E28 0.44 2.96 -8.73 -1.12 0
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185275 77279717 1 ClO2S2N5H20C23 AB2C2D5E20F23 24.08 3.29 -9.14 -1.45 0
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185276 77279718 1 PN2O10C16H21 AB2C10D16E21 -462.7 8.03 -10.26 -0.65 0
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185277 77279719 1 OSN2C13H20 ABC2D13E20 -38.79 2.77 -8.94 -0.13 0
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185278 77279720 1 C4H5N7 A4B5C7 116.77 3.56 -9.78 -0.97 0
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185279 77279772 1 NO5C42H53 AB5C42D53 -150.6 4.02 -9.02 -1.1 0
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185280 77279773 1 N2O6C25H38 A2B6C25D38 -254.51 6.83 -9.58 -0.62 0
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185281 77279905 1 N7O7C33H51 A7B7C33D51 -325.84 5.16 -8.86 0.18 0
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185282 77280971 1 SCl2N3O5C13H13 AB2C3D5E13F13 -109.82 6.85 -9.6 -3.03 0
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185283 77280972 1 SCl2N3O5H13C17 AB2C3D5E13F17 -78.11 7.46 -9.22 -2.96 0
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185284 77281072 1 ClON3C22H24 ABC3D22E24 39.44 3.28 -8.68 -1.65 0
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185285 77281419 1 F3N3O4C24H26 A3B3C4D24E26 -252.82 2.26 -8.6 -1.12 0
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185286 77281580 1 SN4O6C24H28 AB4C6D24E28 -202.37 7.33 -9.42 -1.26 0
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185287 77281638 1 OS2N4H10C12 AB2C4D10E12 56.82 5.23 -8.84 -1.35 0
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185288 77281758 1 SO4N6C25H30 AB4C6D25E30 -30.01 9.33 -8.34 -1.65 0
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185289 77281772 1 SF2N3O3H25C27 AB2C3D3E25F27 -132.94 4.98 -9.18 -0.39 0
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185290 77281773 1 ClFSN3O3H25C27 ABCD3E3F25G27 -98.42 5.43 -9.11 -0.43 0
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185291 77281819 1 FO2N3C20H20 AB2C3D20E20 -49.96 7.53 -8.76 -0.5 0
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185292 77281891 1 OF2N6H20C21 AB2C6D20E21 -25.15 6.26 -8.42 -1.74 0
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185293 77281893 1 FON7C23H26 ABC7D23E26 18.17 4.65 -8.03 -1.23 0
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185294 77281894 1 ON6C21H22 AB6C21D22 63.42 7.59 -8.6 -1.14 0
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185295 77281895 1 O2N5C22H23 A2B5C22D23 8.17 7.96 -8.66 -1.16 1
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185296 77281993 1 N3F5O5C34H35 A3B5C5D34E35 -384.32 4.84 0.0 0.0 1