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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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390987 135002058 1 NOC20H31 ABC20D31 -54.46 3.57 -9.27 -0.38 0
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390988 135002059 1 NO2C22H27 AB2C22D27 -44.46 3.57 -8.85 -0.65 0
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390989 135002060 1 NO2C21H25 AB2C21D25 -40.02 4.95 -9.1 -0.63 0
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390990 135002066 1 O4C17H22 A4B17C22 -163.38 2.54 -9.64 0.06 0
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390991 135002068 1 NO4C17H21 AB4C17D21 -115.95 4.41 -8.85 -1.03 0
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390992 135002072 1 BrNO2H22C24 ABC2D22E24 8.47 4.04 -8.78 -0.71 0
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390993 135002081 1 ClNO2C19H20 ABC2D19E20 -34.0 2.85 -9.07 -0.72 0
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390994 135002083 1 BrNOC19H26 ABCD19E26 14.78 3.76 -8.32 -0.37 0
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390995 135002087 1 NO4H25C27 AB4C25D27 -54.39 7.55 -8.22 -0.72 0
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390996 135002093 1 NO3H21C27 AB3C21D27 13.96 2.95 -8.46 -0.84 0
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390997 135002099 1 ClNO6H20C22 ABC6D20E22 -179.48 3.34 -8.76 -1.24 0
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390998 135002100 1 OSiN2C22H44 ABC2D22E44 -138.22 3.97 -8.19 0.58 0
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390999 135002106 1 NO7C17H21 AB7C17D21 -218.92 5.91 -10.25 -1.38 0
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391000 135002123 1 N2C15H18 A2B15C18 22.7 4.58 -8.7 0.07 0
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391001 135002134 1 NC19H21 AB19C21 52.63 2.26 -8.03 0.15 0
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391002 135002141 1 FOC14H19 ABC14D19 -83.81 1.04 -9.31 0.27 0
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391003 135002146 1 N3O5C26H29 A3B5C26D29 -128.06 6.06 -9.41 -1.02 0
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391004 135002158 1 O2H20C27 A2B20C27 27.19 3.38 -8.73 -0.58 0
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391006 135002176 1 BrInSi2F4C24H42 ABC2D4E24F42 -227.88 6.97 -9.41 -1.24 0
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391007 135002181 1 NO2C16H17 AB2C16D17 -22.1 3.77 -8.14 -0.42 0
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391008 135002185 2 C9H10 A9B10 94.6 0.88 -8.94 -0.04 0
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391009 135002216 1 N2O7C26H32 A2B7C26D32 -291.14 2.51 -9.38 -0.06 0
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391010 135002218 1 N3O3C19H19 A3B3C19D19 -8.67 5.3 -8.71 -1.49 0
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391011 135002219 1 N2O2C17H18 A2B2C17D18 -35.67 3.48 -8.54 0.1 0
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391012 135002221 1 N2O5C18H22 A2B5C18D22 -185.44 1.85 -8.6 -0.36 0
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391013 135002227 1 NO2C16H21 AB2C16D21 -59.14 4.31 -8.8 -0.06 0
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391014 135002234 1 N2O11C39H60 A2B11C39D60 -547.91 3.55 -9.52 0.15 0
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391015 135002235 1 N2O12C37H58 A2B12C37D58 -575.78 6.34 -9.38 -0.04 0
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391016 135002241 1 BrSN2C21H21 ABC2D21E21 58.8 6.16 -8.48 -0.51 0
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391017 135002251 1 NO4C19H21 AB4C19D21 -131.69 4.2 -8.35 -0.94 0
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391018 135002258 1 N3O7C32H41 A3B7C32D41 -271.9 1.46 -8.57 -0.21 0
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391019 135002276 1 NO2H23C24 AB2C23D24 4.82 3.82 -8.89 -0.68 0
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391020 135002277 1 NO4C17H21 AB4C17D21 -110.88 5.01 -8.5 -1.02 0
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391021 135002281 1 N2O3H16C23 A2B3C16D23 61.83 5.06 -9.08 -1.7 0
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391022 135002286 1 NO4C16H17 AB4C16D17 -98.77 3.65 -8.91 -1.28 0
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391023 135002287 1 NS2O3H11C13 AB2C3D11E13 -51.58 2.24 -9.31 -1.88 0
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391024 135002299 2 NOC13H13 ABC13D13 -0.04 5.47 -9.29 -0.42 0
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391025 135002300 1 NO5C16H21 AB5C16D21 -209.41 1.54 -8.93 0.01 0
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391026 135002301 1 NO5C16H21 AB5C16D21 -208.42 3.81 -8.96 0.0 0
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391027 135002323 1 SN2O3C32H40 AB2C3D32E40 -82.04 5.12 -8.56 -0.23 0
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391028 135002332 1 N5H19C28 A5B19C28 205.61 1.87 -8.52 -0.36 0
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391029 135002333 2 O3C13H14 A3B13C14 -206.0 6.29 -9.61 -0.77 0
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391030 135002334 1 SO4C24H32 AB4C24D32 -178.21 6.11 -9.79 -0.89 0
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391031 135002335 1 NO4C31H43 AB4C31D43 -21.3 2.79 -8.06 -0.11 0
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391032 135002338 1 ON2C22H26 AB2C22D26 0.56 5.31 -8.5 -0.04 0
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391033 135002340 1 ClNOC19H22 ABCD19E22 0.51 1.5 -7.99 -0.27 0
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391034 135002349 1 NO4C19H23 AB4C19D23 -117.29 4.4 -8.7 -0.62 0
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391035 135002352 1 NSiH21C23 ABC21D23 67.99 4.93 -9.06 -0.91 0
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391036 135002366 1 SN3O5C17H29 AB3C5D17E29 -216.41 7.71 -9.11 -0.58 0
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391037 135002386 1 N2C23H26 A2B23C26 66.65 1.74 -9.05 0.27 0
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391038 135002388 1 SN3H15C22 AB3C15D22 181.69 4.37 -9.05 -1.56 0
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391039 135002389 1 ClN3O5H12C14 AB3C5D12E14 -87.11 5.09 -9.42 -1.07 0
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391040 135002393 1 NOCl2H7C9 ABC2D7E9 -0.23 1.9 -10.04 -1.52 0
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391041 135002394 1 OC19H20 AB19C20 6.38 2.78 -9.39 0.18 0
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391042 135002419 1 NO2H23C25 AB2C23D25 24.61 3.85 -8.33 -0.34 0
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391043 135002428 1 BrO3C16H21 AB3C16D21 -108.31 2.71 -9.48 -0.82 0
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391044 135002433 1 CrSN2O2H18C19 ABC2D2E18F19 74.74 4.7 -7.67 -0.49 0
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391045 135002456 1 NO2C16H21 AB2C16D21 -58.68 5.14 -9.49 0.27 0
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391046 135002462 1 NO3C22H23 AB3C22D23 -72.63 2.32 -8.49 -0.51 0
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391047 135002463 1 NO4C19H23 AB4C19D23 -129.42 4.0 -8.36 0.12 0
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391048 135002483 1 N2O4C19H20 A2B4C19D20 -77.82 1.78 -8.84 -0.11 0
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391049 135002485 1 N3O4C23H27 A3B4C23D27 -39.46 9.0 -8.61 -1.23 0
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391050 135002494 1 NPO7C25H32 ABC7D25E32 -331.51 3.82 -9.38 -0.89 0
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391051 135002516 1 N2O7H34C35 A2B7C34D35 -206.08 2.66 -8.87 -0.18 0
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391052 135002517 1 N2O7H34C35 A2B7C34D35 -208.66 2.81 -8.9 -0.26 0
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391053 135002520 1 NSO2C15H25 ABC2D15E25 -98.52 2.82 -8.42 0.3 0
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391054 135002522 1 NF3O3H22C23 AB3C3D22E23 -225.05 9.73 -8.53 -0.46 0
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391055 135002529 1 NO4C26H27 AB4C26D27 -84.74 5.37 -8.69 -0.55 0
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391056 135002533 1 ON3C14H19 AB3C14D19 14.49 3.07 -9.68 -0.18 0
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391057 135002546 1 NO2C24H31 AB2C24D31 -62.36 3.67 -8.9 -0.23 0
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391058 135002547 1 ON5C27H27 AB5C27D27 191.46 6.17 -8.6 -0.5 0
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391059 135002555 1 N2O3C19H22 A2B3C19D22 -8.22 5.5 -8.84 -1.22 1
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391060 135002561 1 NO2C18H18 AB2C18D18 -10.3 1.7 0.0 0.0 0
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391061 135002568 1 INO2C17H18 ABC2D17E18 -29.81 3.55 -8.66 -0.77 0
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391062 135002571 1 O3N4C17H20 A3B4C17D20 -80.43 5.15 -8.95 -0.61 0