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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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39303 8140142 1 SO2N3C22H30 AB2C3D22E30 -25.16 2.39 0.0 0.0 0
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39304 8140149 1 O3N4C24H26 A3B4C24D26 12.74 2.88 -9.04 -1.05 0
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39305 8140160 1 OSN2C18H22 ABC2D18E22 1.68 5.51 -8.93 -0.46 1
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39306 8140177 1 N3O3C24H34 A3B3C24D34 -87.72 5.53 0.0 0.0 1
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39307 8140202 1 ClSN3O3C19H25 ABC3D3E19F25 -71.93 7.27 0.0 0.0 1
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39308 8140205 1 O2N3C18H26 A2B3C18D26 -13.5 1.83 0.0 0.0 0
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39309 8140206 1 O2N3C18H25 A2B3C18D25 -31.77 5.68 -9.29 0.1 0
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39310 8140213 1 N3O3C23H27 A3B3C23D27 -30.08 6.45 -9.12 -0.27 0
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39311 8140214 1 FN3O4C16H18 AB3C4D16E18 -154.71 1.58 -8.61 -0.57 1
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39312 8140215 1 BrN2O2C20H26 AB2C2D20E26 -31.03 3.05 0.0 0.0 0
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39313 8140228 1 FS2O3N4H11C17 AB2C3D4E11F17 33.9 5.86 -9.61 -2.03 0
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39314 8140229 1 FS2O3N4H11C17 AB2C3D4E11F17 34.99 5.95 -9.53 -1.99 0
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39315 8140230 1 S2N3O3H15C18 A2B3C3D15E18 48.05 8.97 -9.22 -1.76 1
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39316 8140242 1 N4O4C21H27 A4B4C21D27 -20.36 6.53 0.0 0.0 1
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39317 8140248 1 N2O2C22H31 A2B2C22D31 -44.13 0.88 0.0 0.0 0
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39318 8140252 2 NOC11H15 ABC11D15 -62.86 3.34 -8.84 0.15 0
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39319 8140253 1 SO2N4H12C13 AB2C4D12E13 8.18 2.63 -8.94 -1.25 0
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39320 8140261 1 BrOSN4H11C17 ABCD4E11F17 95.0 6.08 -9.07 -1.4 0
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39321 8140262 1 SO3N5H13C19 AB3C5D13E19 18.05 4.66 -9.19 -1.56 1
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39322 8140263 1 SN3O3C23H34 AB3C3D23E34 -91.91 7.52 0.0 0.0 1
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39323 8140266 1 ON2C21H27 AB2C21D27 0.83 4.89 0.0 0.0 0
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39324 8140267 1 ON2C21H26 AB2C21D26 -16.45 4.2 -8.52 -0.22 0
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39325 8140268 1 ClOS2N4H9C15 ABC2D4E9F15 97.34 4.61 -9.01 -1.35 0
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39326 8140275 1 SF2O2N4H14C19 AB2C2D4E14F19 -60.74 5.27 -9.22 -1.62 0
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39327 8140276 1 OSF2N4H10C17 ABC2D4E10F17 1.09 6.42 -9.17 -1.51 0
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39328 8140280 1 OSN4H18C20 ABC4D18E20 74.31 3.63 -8.8 -1.21 0
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39329 8140283 1 SO2N5H17C20 AB2C5D17E20 36.31 8.45 -8.92 -1.3 0
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39330 8140290 1 O3N4C21H26 A3B4C21D26 -14.41 7.5 -8.72 -0.74 1
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39331 8140295 1 ClON4C22H26 ABC4D22E26 51.76 2.51 0.0 0.0 1
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39332 8140301 1 BrClN2O2C18H21 ABC2D2E18F21 -19.79 4.22 0.0 0.0 1
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39333 8140303 1 BrFN2O2C18H21 ABC2D2E18F21 -59.01 4.29 0.0 0.0 0
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39334 8140314 1 ClN2O2C18H21 AB2C2D18E21 -45.34 4.87 -8.95 -0.35 0
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39335 8140328 1 N2O3C22H28 A2B3C22D28 -66.34 3.0 -8.41 -0.59 1
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39336 8140331 1 FSO2N4C20H22 ABC2D4E20F22 -9.84 5.49 0.0 0.0 1
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39337 8140351 1 ClO2N3C23H29 AB2C3D23E29 -39.51 4.34 0.0 0.0 0
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39338 8140362 1 N3O3C23H29 A3B3C23D29 -80.03 6.18 -8.87 -0.22 1
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39339 8140365 1 BrN2O2C19H24 AB2C2D19E24 -19.38 2.55 0.0 0.0 0
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39340 8140368 1 O2N3C24H35 A2B3C24D35 -102.66 1.52 -8.96 -0.05 1
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39341 8140369 1 N2O3C21H25 A2B3C21D25 -40.79 5.22 0.0 0.0 1
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39342 8140377 1 OSN2C18H23 ABC2D18E23 21.88 1.93 0.0 0.0 1
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39343 8140381 1 ClON4C20H22 ABC4D20E22 63.45 5.18 0.0 0.0 0
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39344 8140384 1 OS2N4C21H26 AB2C4D21E26 9.63 3.16 -8.63 -0.97 1
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39345 8140385 1 ClN2O3C19H24 AB2C3D19E24 -61.33 4.31 0.0 0.0 1
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39346 8140389 1 N2O2C20H27 A2B2C20D27 -31.93 2.76 0.0 0.0 1
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39347 8140393 1 O2N3C22H28 A2B3C22D28 -33.4 4.1 0.0 0.0 0
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39348 8140394 1 O2N3C22H27 A2B3C22D27 -56.02 2.87 -8.57 0.1 0
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39349 8140416 1 FON2C18H21 ABC2D18E21 -50.08 3.02 -8.86 -0.15 1
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39350 8140429 1 O3N4C20H25 A3B4C20D25 28.6 6.31 0.0 0.0 1
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39351 8140433 1 SN2O3C18H23 AB2C3D18E23 -60.78 4.93 0.0 0.0 0
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39352 8140444 1 ClN2O2C18H21 AB2C2D18E21 -48.09 3.48 -9.19 -0.22 1