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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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446902 135278634 1 SN2F3O5C24H27 AB2C3D5E24F27 -284.36 6.48 -8.78 -1.08 0
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446903 135278649 1 BrNOF2H12C15 ABCD2E12F15 -59.16 4.74 -8.56 -0.53 0
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446904 135278653 1 BrIPN2C8H9 ABCD2E8F9 16.12 1.87 -8.95 -0.96 1
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446905 135278692 1 SN2O2C26H29 AB2C2D26E29 18.14 3.97 0.0 0.0 1
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446906 135278697 1 SN4O5C21H27 AB4C5D21E27 -114.99 2.75 0.0 0.0 0
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446907 135278715 1 OF2N7C28H35 AB2C7D28E35 -13.89 3.03 -7.89 -0.3 0
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446908 135278718 1 O2N5C21H21 A2B5C21D21 76.41 5.79 -8.45 -0.76 0
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446909 135278719 1 FON8C27H31 ABC8D27E31 70.64 2.37 -7.88 -0.53 0
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446910 135278730 1 SN3C24H31 AB3C24D31 22.41 4.57 -8.09 -0.26 0
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446911 135278731 1 FSN2O4H23C25 ABC2D4E23F25 -53.11 6.41 -8.53 -0.89 0
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446912 135278747 1 SN2O4C21H24 AB2C4D21E24 -72.95 5.21 -8.55 -0.85 0
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446913 135278753 1 SF2N3O4H17C24 AB2C3D4E17F24 -52.29 6.31 -8.48 -1.15 0
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446914 135278755 1 BrFSN3O4H19C22 ABCD3E4F19G22 -61.33 7.92 -8.61 -1.11 0
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446915 135278757 1 SN3O3C24H31 AB3C3D24E31 -51.6 10.93 -8.52 -0.98 0
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446916 135278765 1 SN2O4C25H32 AB2C4D25E32 -92.99 4.75 -8.52 -0.89 0
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446917 135278767 1 SN2O4C23H28 AB2C4D23E28 -82.24 11.28 -8.37 -0.93 0
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446918 135278797 1 IS2N4C17H19 AB2C4D17E19 84.0 4.31 -7.93 -2.42 0
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446919 135278802 1 N2S2O3C13H20 A2B2C3D13E20 -93.63 1.59 -8.85 -0.8 0
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446920 135278807 1 OSN3H21C24 ABC3D21E24 67.5 5.24 -8.54 -0.37 0
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446921 135278810 1 O4N6C29H40 A4B6C29D40 -133.37 2.62 -8.75 -0.74 0
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446922 135278816 1 FSN2O3H15C17 ABC2D3E15F17 -34.04 8.58 -8.67 -1.07 0
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446923 135278820 1 O4N6C27H38 A4B6C27D38 -87.26 3.15 -8.85 -0.44 0
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446924 135278826 1 OSN3F5H16C22 ABC3D5E16F22 -189.54 3.67 -8.69 -1.01 0
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446925 135278833 1 BrSF4H7C9 ABC4D7E9 -190.78 2.3 -9.5 -1.12 1
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446926 135278844 1 SF2O2N3H22C24 AB2C2D3E22F24 -19.12 4.69 0.0 0.0 0
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446927 135278848 1 SN7C34H63 AB7C34D63 -18.13 2.29 -8.12 -0.07 1
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446928 135278853 1 SN3O4C21H26 AB3C4D21E26 -79.49 6.63 0.0 0.0 0
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446929 135278865 1 NSO3C20H25 ABC3D20E25 -85.16 4.87 -8.57 -0.16 0
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446930 135278892 1 ClFN3O5H45C47 ABC3D5E45F47 -105.81 4.58 -8.6 -1.14 1
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446931 135278905 1 N2O2S2C22H23 A2B2C2D22E23 43.54 3.57 0.0 0.0 0
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446932 135278907 1 NSO3C15H19 ABC3D15E19 -78.37 3.79 -8.94 -0.82 0
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446933 135278915 1 NO6C19H39 AB6C19D39 -305.04 4.17 -9.8 0.9 0
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446934 135278931 1 FNO2C17H26 ABC2D17E26 -144.85 2.32 -9.1 0.13 0
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446935 135278932 2 NO3C17H22 AB3C17D22 -186.67 8.74 -8.81 -0.92 0
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446936 135278937 2 NOC7H15 ABC7D15 -144.05 5.12 -8.65 1.23 0
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446937 135278947 1 N5O5C40H41 A5B5C40D41 -97.03 8.94 -8.55 -0.9 0
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446938 135278986 1 IN3O4C13H16 AB3C4D13E16 -168.42 4.43 -9.12 -1.81 1
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446939 135278988 1 SN2O2C16H17 AB2C2D16E17 11.1 1.18 0.0 0.0 1
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446940 135278989 1 SN2O2C21H25 AB2C2D21E25 -6.16 3.23 0.0 0.0 0
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446941 135279013 1 ClN2O2C23H27 AB2C2D23E27 -21.94 7.58 -9.44 -0.72 1
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446942 135279016 1 SO2N3H22C24 AB2C3D22E24 74.39 5.03 0.0 0.0 0
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446943 135279020 1 NS2O6C19H31 AB2C6D19E31 -233.04 1.89 -8.01 -0.08 0
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446944 135279022 1 O2N3C25H25 A2B3C25D25 25.43 6.92 -8.48 -0.75 0
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446945 135279025 1 IOF2N2S2H21C24 ABC2D2E2F21G24 -33.13 3.58 -8.73 -2.45 1
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446946 135279029 1 SF2O2N3C26H26 AB2C2D3E26F26 -23.62 5.84 0.0 0.0 0
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446947 135279030 1 PSF2O2N3H24C25 ABC2D2E3F24G25 -57.38 6.36 -8.58 -0.48 0
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446948 135279033 1 SF2N3H25C26 AB2C3D25E26 0.09 3.66 -8.4 -0.36 0
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446949 135279037 1 N2O9C34H72 A2B9C34D72 -468.44 1.4 -8.57 1.24 0
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446950 135279049 1 SN3O3C25H33 AB3C3D25E33 -55.13 10.12 -8.55 -0.97 0
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446951 135279064 1 SN3O3C23H29 AB3C3D23E29 -47.41 5.8 -8.63 -1.03 0
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446952 135279067 1 BrFSN2O4H18C23 ABCD2E4F18G23 -35.12 7.75 -8.6 -1.1 0
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446953 135279070 1 PSF2O2N4H25C26 ABC2D2E4F25G26 -93.23 2.26 -8.55 -0.66 0
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446954 135279076 1 N2O2C21H30 A2B2C21D30 -61.58 4.6 -9.02 -0.45 0
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446955 135279080 1 INSF2O4H16C19 ABCD2E4F16G19 -190.74 6.21 -9.23 -2.54 0
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446956 135279088 1 N3C14H29 A3B14C29 -11.65 2.05 -8.15 2.56 0
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446957 135279095 1 O3N4C21H42 A3B4C21D42 -124.81 1.6 -8.37 1.85 0
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446958 135279097 1 ClN5O6C38H46 AB5C6D38E46 -230.82 11.42 -9.3 -0.73 0
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446959 135279098 1 ON3C14H17 AB3C14D17 -11.37 4.74 -8.4 -0.27 0
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446960 135279116 1 NS2O3C6H13 AB2C3D6E13 -94.64 3.52 -9.29 -1.37 0
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446961 135279118 1 OSN2C20H22 ABC2D20E22 31.58 2.58 -8.49 -0.36 0
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446962 135279134 1 O5N7C31H39 A5B7C31D39 -140.77 6.06 -8.52 -0.51 0
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446963 135279148 2 N2O3C12H15 A2B3C12D15 -225.93 6.17 -9.02 -1.05 0
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446964 135279150 1 OSF2C8H8 ABC2D8E8 -107.27 3.7 -9.17 -0.98 1
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446965 135279153 1 NOC16H32 ABC16D32 -53.11 1.95 0.0 0.0 1
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446966 135279154 1 NOC14H30 ABC14D30 -46.68 3.15 0.0 0.0 0
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446967 135279165 1 N2O5C31H38 A2B5C31D38 -84.44 4.68 -8.52 0.04 0
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446968 135279166 1 ON4C36H36 AB4C36D36 116.12 4.06 -8.43 -0.36 0
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446969 135279173 2 NO5C17H36 AB5C17D36 -500.45 2.23 -9.02 1.01 0
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446970 135279198 1 ON5H23C24 AB5C23D24 82.85 6.94 -8.82 -0.81 0
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446971 135279214 1 O3N5C18H31 A3B5C18D31 -37.17 4.72 -8.24 0.0 0
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446972 135279219 2 O2C12H15 A2B12C15 -151.78 3.13 -9.16 -0.48 0
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446973 135279239 1 FO3N6C26H35 AB3C6D26E35 -111.87 1.29 -8.8 -0.8 0
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446974 135279240 1 FO3N6C26H35 AB3C6D26E35 -110.99 2.31 -8.75 -0.75 0
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446975 135279241 1 FO3N6C26H37 AB3C6D26E37 -131.82 2.11 -8.65 -0.32 0
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446976 135279242 1 N5O5C42H43 A5B5C42D43 -104.61 8.27 -8.49 -0.84 0
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446977 135279247 2 NC10H20 AB10C20 -34.98 1.01 -8.32 3.0 0
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446978 135279248 1 NSO3C15H19 ABC3D15E19 -69.72 4.4 -8.77 -1.02 0
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446979 135279257 1 ON3C17H35 AB3C17D35 -55.04 2.19 -8.38 1.13 0
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446980 135279281 1 ON4C34H38 AB4C34D38 59.84 5.16 -8.1 -0.18 0
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446981 135279289 1 ClFON5C20H23 ABCD5E20F23 -21.7 4.79 -9.11 -0.87 0
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446982 135279291 1 SO4N6C24H32 AB4C6D24E32 -74.93 7.88 -8.72 -0.7 0
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446983 135279303 6 NC5H10 AB5C10 -27.14 3.24 -8.08 2.54 0
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446984 135279307 1 FON6C21H25 ABC6D21E25 16.9 4.84 -8.63 -0.61 0
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446985 135279310 1 ON2C16H26 AB2C16D26 -44.93 1.71 -8.87 0.04 0
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446986 135279313 1 NOC20H33 ABC20D33 -53.9 2.78 -8.71 0.24 0
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446987 135279318 1 FO2N3C21H30 AB2C3D21E30 -116.11 1.28 -8.57 -0.12 0
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446988 135279326 1 N2O3C13H20 A2B3C13D20 -92.75 3.32 -8.82 -0.41 0
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446989 135279335 1 N2O5C34H46 A2B5C34D46 -149.34 4.08 -7.97 0.17 0
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446990 135279350 1 FO3N6C26H33 AB3C6D26E33 -85.59 1.41 -8.75 -0.72 0
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446991 135279362 2 O2N3H20C21 A2B3C20D21 -9.93 5.68 -8.38 -0.59 0
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446992 135279371 1 F2N3C15H19 A2B3C15D19 -58.4 1.34 -8.94 -0.45 0
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446993 135279373 1 F2N3O3H21C23 A2B3C3D21E23 -135.43 4.54 -8.78 -0.75 -1
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446994 135279388 1 SN2O5C25H29 AB2C5D25E29 -72.49 6.99 0.0 0.0 0
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446995 135279391 1 OSC17H24 ABC17D24 -28.57 3.3 -8.68 0.49 0
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446996 135279394 3 O2H8C9 A2B8C9 -173.25 3.21 -9.38 -0.96 0
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446997 135279406 1 SN4O6C26H36 AB4C6D26E36 -166.1 2.45 -7.03 -0.6 0
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446998 135279413 1 F3O3N4C26H27 A3B3C4D26E27 -173.16 4.33 -8.76 -0.74 0
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446999 135279419 1 FO3N5H24C26 AB3C5D24E26 -13.82 5.21 -9.34 -0.72 0
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447000 135279422 1 FN3O3H26C29 AB3C3D26E29 -54.47 10.82 -9.32 -0.92 0
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447001 135279426 1 FN2O4C27H27 AB2C4D27E27 -132.52 11.31 -9.41 -0.67 0