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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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61951 26716198 1 SN2O3H20C21 AB2C3D20E21 -42.97 3.84 -8.93 -0.91 0
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61952 26716204 1 N3O3C25H35 A3B3C25D35 -147.95 4.6 -8.88 0.12 0
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61953 26716206 1 SN3O6C22H27 AB3C6D22E27 -187.3 7.28 -9.0 -1.0 0
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61954 26716238 1 N2O3C18H24 A2B3C18D24 -97.86 1.05 -8.9 0.02 0
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61955 26716262 1 BrN2O4C18H19 AB2C4D18E19 -103.89 2.27 -8.92 -0.2 0
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61956 26716298 1 FN3O3C22H22 AB3C3D22E22 -97.41 3.02 -8.74 -0.68 0
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61957 26716308 1 ClN2O4H21C23 AB2C4D21E23 -81.5 1.56 -8.73 -0.62 1
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61958 26716316 1 BrO2N3C19H29 AB2C3D19E29 -84.9 8.04 0.0 0.0 0
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61959 26716318 1 BrO2N3C19H22 AB2C3D19E22 -96.88 6.71 -8.54 -0.34 0
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61960 26716327 1 SN2O4H22C25 AB2C4D22E25 -65.34 7.45 -9.22 -0.96 0
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61961 26716329 1 SN3O3C22H35 AB3C3D22E35 -134.17 7.69 -8.6 -0.29 0
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61962 26716331 1 SN3O3C19H31 AB3C3D19E31 -129.88 6.75 -8.6 -0.81 0
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61963 26716333 1 O3N4C19H28 A3B4C19D28 -37.7 9.04 -8.84 -1.09 0
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61964 26716334 1 SN2O5H22C23 AB2C5D22E23 -140.47 5.75 -9.45 -1.12 0
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61965 26716335 1 SN2O4C24H24 AB2C4D24E24 -103.69 8.69 -9.22 -1.08 0
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61966 26716338 1 ClSN2O3C23H23 ABC2D3E23F23 -78.42 6.26 -8.84 -1.03 1
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61967 26716339 1 SN3O3C25H36 AB3C3D25E36 -88.53 3.48 0.0 0.0 0
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61968 26716371 1 ClSN3O3C22H28 ABC3D3E22F28 -101.67 10.71 -8.73 -1.08 0
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61969 26716373 1 ClSN3O3C22H28 ABC3D3E22F28 -98.62 6.83 -8.63 -1.2 1
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61970 26716383 1 O2N4C21H31 A2B4C21D31 -47.03 17.68 0.0 0.0 1
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61971 26716386 1 SN4O5C22H29 AB4C5D22E29 -89.27 3.82 0.0 0.0 0
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61972 26716395 1 NO4H21C23 AB4C21D23 -89.63 6.96 -8.23 -0.55 0
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61973 26716420 1 FSN2O4C20H23 ABC2D4E20F23 -172.33 7.45 -8.89 -1.29 1
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61974 26716426 1 SO2N3C19H28 AB2C3D19E28 -83.51 9.71 0.0 0.0 1
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61975 26716434 1 O2N3C20H30 A2B3C20D30 -83.34 5.83 0.0 0.0 0
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61976 26716446 1 FNO3H20C23 ABC3D20E23 -113.25 2.66 -8.64 -0.39 0
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61977 26716451 1 SN3O4C24H33 AB3C4D24E33 -139.26 5.13 -8.82 -0.76 0
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61978 26716469 1 N2O5C20H22 A2B5C20D22 -131.55 4.43 -9.11 -0.68 0
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61979 26716470 1 ClSN2O5C22H25 ABC2D5E22F25 -188.0 3.79 -9.35 -1.38 0
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61980 26716475 1 N3O6C19H19 A3B6C19D19 -139.02 2.83 -9.56 -1.7 0
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61981 26716506 1 ClNO4H18C23 ABC4D18E23 -102.95 6.52 -9.03 -0.92 0
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61982 26716513 2 NO2C10H12 AB2C10D12 -145.13 2.26 -8.4 -0.12 0
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61983 26716559 2 NO2C11H12 AB2C11D12 -119.25 5.41 -8.7 -0.3 0
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61984 26716561 1 N2O3C20H22 A2B3C20D22 -78.78 2.83 -8.8 -0.4 0
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61985 26716575 1 ClSN4O5H15C16 ABC4D5E15F16 -122.2 4.83 -8.68 -1.49 0
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61986 26716593 1 N3O4H27C28 A3B4C27D28 -71.35 7.73 -8.9 -0.64 0
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61987 26716603 1 SN2O5C22H28 AB2C5D22E28 -202.33 6.2 -9.33 -0.67 0
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61988 26716605 1 N3O3C19H23 A3B3C19D23 -85.47 8.92 -8.93 -0.65 0
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61989 26716660 1 ClNO5H18C23 ABC5D18E23 -127.64 1.6 -8.6 -0.81 0
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61990 26716699 1 FNO4H18C19 ABC4D18E19 -143.3 2.5 -8.67 -0.81 0
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61991 26716706 1 SN2O5C20H24 AB2C5D20E24 -184.13 3.58 -9.42 -1.32 0
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61992 26716730 1 SN2O5C21H26 AB2C5D21E26 -187.79 7.37 -9.43 -1.31 0
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61993 26716737 1 N2O3H18C20 A2B3C18D20 -48.68 4.11 -9.3 -1.65 0
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61994 26716738 1 SN2O5C20H24 AB2C5D20E24 -187.14 4.2 -9.34 -0.93 0
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61995 26716750 1 SN2O5C26H26 AB2C5D26E26 -130.48 4.25 -8.61 -0.51 0
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61996 26716774 1 SN2O6C22H22 AB2C6D22E22 -172.29 6.25 -9.45 -1.42 0
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61997 26716803 1 NSO5C19H21 ABC5D19E21 -183.1 10.13 -8.96 -1.03 0
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61998 26716805 1 SN2O5C20H24 AB2C5D20E24 -181.35 7.74 -9.11 -0.87 1
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61999 26716829 1 ClSN3O5C23H29 ABC3D5E23F29 -156.37 3.43 0.0 0.0 0
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62000 26716834 1 ClSN2O5H15C21 ABC2D5E15F21 -47.72 5.19 -8.89 -1.93 0
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62001 26716837 1 N2O5H18C19 A2B5C18D19 -85.18 1.68 -9.41 -1.91 0
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62002 26716860 1 BrNO4C20H20 ABC4D20E20 -136.56 2.02 -9.34 -1.17 0
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62003 26716870 1 NSO3C20H21 ABC3D20E21 -65.56 5.71 -8.74 -0.69 0
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62004 26716874 1 SN4O6H16C21 AB4C6D16E21 -51.74 5.94 -9.72 -1.4 0
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62005 26716911 1 O3N4C18H18 A3B4C18D18 -92.27 8.07 -8.43 -0.71 0
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62006 26716915 1 SN2O5C21H26 AB2C5D21E26 -183.5 3.8 -9.4 -1.22 0
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62007 26716916 1 NO6C20H23 AB6C20D23 -210.67 6.87 -8.61 -0.71 0
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62008 26716947 2 NO2C10H11 AB2C10D11 -144.34 3.13 -9.4 -0.72 0
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62009 26716961 1 N2O2C19H20 A2B2C19D20 -35.94 4.22 -8.8 -0.49 0
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62010 26716963 1 SO2N3C21H23 AB2C3D21E23 -45.88 0.83 -8.75 -0.94 0
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62011 26716968 1 S2N4O4C23H28 A2B4C4D23E28 -117.99 4.76 -8.82 -1.06 0
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62012 26716970 1 NO5C20H21 AB5C20D21 -176.25 6.0 -8.94 -0.55 0
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62013 26716979 1 S2N4O4H20C23 A2B4C4D20E23 -22.41 6.58 -8.94 -1.27 0
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62014 26716996 1 ON2H20C24 AB2C20D24 55.12 3.2 -8.88 -1.1 0
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62015 26717001 1 ON3H19C23 AB3C19D23 69.6 4.08 -9.01 -1.38 0
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62016 26717008 1 O2N3C25H27 A2B3C25D27 -41.48 5.22 -8.68 -0.62 0
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62017 26717019 1 ClN2O4C27H29 AB2C4D27E29 -159.12 6.03 -8.87 -0.89 0
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62018 26717052 1 ON4H20C21 AB4C20D21 61.92 3.58 -9.06 -0.83 0
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62019 26717055 1 ClFO2N5H15C20 ABC2D5E15F20 -29.04 7.26 -8.42 -1.21 0
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62020 26717064 1 N4O4H20C25 A4B4C20D25 -50.64 7.95 -8.53 -1.23 0
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62021 26717070 1 SN2O4H24C27 AB2C4D24E27 -76.26 5.49 -8.97 -1.43 0
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62022 26717079 1 BrSN2O3C21H21 ABC2D3E21F21 -59.11 4.63 -8.81 -1.04 0
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62023 26717093 1 NO4C24H25 AB4C24D25 -88.28 5.73 -8.36 -0.49 0
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62024 26717094 1 NO4C24H25 AB4C24D25 -88.31 5.68 -8.32 -0.51 0
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62025 26717097 1 ClO4N5C24H24 AB4C5D24E24 -69.73 6.83 -9.08 -1.04 0
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62026 26717098 1 SN2O3H14C17 AB2C3D14E17 16.74 4.64 -9.22 -2.04 0
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62027 26717105 1 N2O2C23H24 A2B2C23D24 -47.87 0.56 -9.02 -0.59 0
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62028 26717110 1 SN2O4H22C24 AB2C4D22E24 -64.72 6.42 -9.13 -1.08 0
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62029 26717119 1 Cl2N3O3H17C21 A2B3C3D17E21 -75.48 4.53 -8.78 -0.91 0
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62030 26717122 1 FCl2N3O3H16C18 AB2C3D3E16F18 -153.9 4.15 -8.86 -1.24 0
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62031 26717125 1 Cl2N4O4H16C19 A2B4C4D16E19 -114.1 2.05 -9.01 -1.04 0
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62032 26717127 1 Cl2N3O3C21H23 A2B3C3D21E23 -115.42 5.46 -9.33 -1.29 0
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62033 26717132 1 SN2O4C25H28 AB2C4D25E28 -115.66 3.62 -9.08 -1.03 0
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62034 26717133 1 SN2O4C25H28 AB2C4D25E28 -115.39 3.38 -9.07 -1.02 0
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62035 26717142 1 N2O3H20C27 A2B3C20D27 -22.67 7.7 -8.99 -1.72 0
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62036 26717163 1 ClNOSH14C17 ABCDE14F17 17.8 3.13 -9.02 -1.0 0
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62037 26717171 1 N4O4H22C27 A4B4C22D27 2.3 1.67 -8.82 -0.78 0
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62038 26717177 1 ClN2O7H17C24 AB2C7D17E24 -113.97 6.34 -8.88 -1.93 0
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62039 26717181 1 NO4C22H23 AB4C22D23 -96.64 6.28 -8.9 -0.63 0
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62040 26717183 1 NO4C22H23 AB4C22D23 -95.42 2.47 -8.32 -0.48 0
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62041 26717184 1 SN3O4H17C23 AB3C4D17E23 -19.27 5.81 -8.79 -1.2 0
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62042 26717186 1 ClON2H15C18 ABC2D15E18 18.67 5.37 -9.09 -1.05 0
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62043 26717209 1 NO4C24H25 AB4C24D25 -86.12 4.41 -8.79 -0.55 0
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62044 26717241 1 SN2O4C24H26 AB2C4D24E26 -109.6 6.44 -9.03 -0.86 0
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62045 26717242 1 N2O3H18C20 A2B3C18D20 -0.19 2.6 -8.9 -1.58 0
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62046 26717269 1 SN2O4C22H24 AB2C4D22E24 -109.13 8.65 -9.09 -0.66 0
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62047 26717270 1 SN2O4C22H24 AB2C4D22E24 -110.14 5.98 -9.07 -0.64 0
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62048 26717271 1 BrSN3O4H16C21 ABC3D4E16F21 -52.06 6.77 -9.04 -1.33 0
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62049 26717272 1 SO3N6H18C21 AB3C6D18E21 96.3 2.29 -9.13 -2.05 0
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62050 26717275 1 BrFSN2O4H18C21 ABCD2E4F18G21 -137.03 6.11 -8.83 -1.1 0