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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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61051 26704788 1 ClSN2O5C22H25 ABC2D5E22F25 -166.48 6.65 -9.07 -0.59 0
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61052 26704814 1 NCl2O2H15C17 AB2C2D15E17 -66.23 2.76 -9.05 -0.35 0
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61053 26704884 1 N2S2O6C19H22 A2B2C6D19E22 -195.95 4.86 -9.35 -1.26 0
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61054 26704914 1 NSO3C16H17 ABC3D16E17 -95.64 1.08 -8.77 -0.99 0
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61055 26704917 1 SN2O5H16C18 AB2C5D16E18 -101.26 4.2 -8.87 -1.17 0
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61056 26704919 1 SN2O5C19H20 AB2C5D19E20 -151.33 4.1 -8.8 -0.99 0
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61057 26704926 1 SCl3N3O3H14C18 AB3C3D3E14F18 -67.79 1.34 -8.74 -1.05 0
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61058 26704943 1 SN2O6H20C24 AB2C6D20E24 -160.24 6.06 -8.64 -1.36 0
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61059 26704974 1 ClSN2O7H15C20 ABC2D7E15F20 -118.89 1.63 -9.09 -1.52 0
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61060 26704988 1 ClN2S2O6C19H21 AB2C2D6E19F21 -201.4 6.23 -9.06 -1.42 0
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61061 26704993 1 N2S2O5C23H30 A2B2C5D23E30 -196.54 6.3 -8.89 -1.12 0
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61062 26705024 1 SN5O5C15H15 AB5C5D15E15 -136.55 3.85 -8.96 -0.88 0
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61063 26705050 1 S2N3O5C19H19 A2B3C5D19E19 -120.05 8.27 -9.41 -1.27 0
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61064 26705055 1 ClSN3O4H14C17 ABC3D4E14F17 -69.45 1.18 -8.86 -1.1 0
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61065 26705057 1 ClNSO4H12C15 ABCD4E12F15 -114.34 3.8 -9.04 -1.0 0
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61066 26705087 1 ClSN2O6H19C23 ABC2D6E19F23 -179.54 3.51 -8.86 -1.22 0
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61067 26705162 1 NF3O3C19H20 AB3C3D19E20 -256.15 2.59 -8.91 -0.61 0
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61068 26705169 1 BrNO5C19H20 ABC5D19E20 -150.9 5.13 -8.85 -0.45 0
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61069 26705172 1 FN3O4H20C22 AB3C4D20E22 -109.22 10.66 -8.76 -0.95 0
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61070 26705205 1 NF2O5C21H21 AB2C5D21E21 -254.16 4.68 -9.28 -0.87 0
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61071 26705256 1 ClSN2O5C22H25 ABC2D5E22F25 -177.27 6.76 -9.39 -0.85 0
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61072 26705265 1 BrFNO4H17C18 ABCD4E17F18 -161.08 2.66 -9.47 -0.72 0
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61073 26705284 1 SN2O6C23H28 AB2C6D23E28 -213.2 4.47 -9.65 -1.04 0
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61074 26705286 1 SN2O5C24H30 AB2C5D24E30 -180.59 3.37 -9.41 -0.86 0
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61075 26705309 1 N2O5C22H22 A2B5C22D22 -167.62 8.2 -9.56 -1.47 0
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61076 26705310 1 ClN3O4H20C22 AB3C4D20E22 -83.08 6.29 -9.36 -1.14 0
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61077 26705315 1 SN2O3C22H22 AB2C3D22E22 -63.5 5.88 -9.12 -0.92 0
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61078 26705322 1 SN3O5C23H25 AB3C5D23E25 -138.21 4.87 -9.54 -1.16 0
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61079 26705330 1 SN3O4H15C19 AB3C4D15E19 -100.77 7.96 -9.04 -1.81 0
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61080 26705381 1 N3O4C25H25 A3B4C25D25 -114.95 2.27 -9.01 -0.78 0
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61081 26705407 1 FO3N4H21C25 AB3C4D21E25 -49.89 4.46 -9.0 -0.84 0
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61082 26705408 1 S2F3N3O5C18H22 A2B3C3D5E18F22 -342.52 4.74 -9.15 -0.76 0
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61083 26705412 1 BrNS2O3H16C17 ABC2D3E16F17 -79.57 5.44 -8.65 -0.75 0
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61084 26705447 1 SF2N2O5H18C22 AB2C2D5E18F22 -241.94 3.25 -9.14 -1.23 0
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61085 26705449 1 OS2F3N3H10C16 AB2C3D3E10F16 -97.23 0.17 -9.11 -1.68 0
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61086 26705451 1 OS2N4H14C19 AB2C4D14E19 90.25 3.47 -9.0 -1.28 0
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61087 26705454 1 ClSO2N5H14C19 ABC2D5E14F19 65.15 2.31 -9.12 -1.02 0
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61088 26705484 1 ClNO3H18C19 ABC3D18E19 -102.03 4.86 -8.72 -0.16 0
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61089 26705493 1 N4O4C23H24 A4B4C23D24 -40.65 10.44 -8.88 -0.95 0
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61090 26705516 1 BrNF3O4H17C18 ABC3D4E17F18 -272.19 10.76 -9.08 -0.72 0
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61091 26705544 1 ClSO2N3C19H20 ABC2D3E19F20 -56.44 5.97 -9.12 -1.52 0
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61092 26705553 1 NCl2O2C19H19 AB2C2D19E19 -72.38 3.3 -9.17 -0.45 0
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61093 26705593 1 FN2O2C17H17 AB2C2D17E17 -89.6 4.75 -9.12 -0.87 0
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61094 26705617 1 SN3O3C19H19 AB3C3D19E19 -70.32 5.01 -8.84 -0.68 0
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61095 26705653 1 FSO3N4C21H21 ABC3D4E21F21 -76.41 9.98 -9.01 -1.09 0
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61096 26705654 1 SN3O3C21H25 AB3C3D21E25 -97.48 5.17 -8.7 -0.25 0
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61097 26705663 1 SO2N6H20C21 AB2C6D20E21 24.71 3.94 -8.67 -1.29 0
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61098 26705670 1 O2N5C23H25 A2B5C23D25 -2.02 4.38 -9.04 -1.18 1
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61099 26705680 1 FSO3N4C24H32 ABC3D4E24F32 -100.11 10.03 0.0 0.0 1
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61100 26705688 1 ClFSN4O4C22H27 ABCD4E4F22G27 -132.15 9.47 0.0 0.0 0
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61101 26705705 1 SN3O5C26H33 AB3C5D26E33 -193.1 11.23 -8.67 -0.32 0
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61102 26705711 1 FN4O5C23H23 AB4C5D23E23 -133.57 5.73 -8.38 -1.02 0
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61103 26705722 1 SN3O5C26H31 AB3C5D26E31 -167.13 12.81 -8.7 -0.7 0
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61104 26705729 1 ClSN2O5C22H25 ABC2D5E22F25 -170.39 5.36 -9.18 -0.57 0
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61105 26705732 1 SN3O5C25H31 AB3C5D25E31 -180.7 6.17 -8.73 -0.36 0
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61106 26705736 1 SN3O6C20H27 AB3C6D20E27 -250.69 8.99 -8.89 -0.39 0
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61107 26705742 1 FN4O4C23H23 AB4C4D23E23 -105.61 6.73 -8.82 -1.03 0
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61108 26705745 1 FON5H12C15 ABC5D12E15 37.46 10.72 -9.34 -1.23 0
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61109 26705749 1 OSF3N5H10C15 ABC3D5E10F15 -65.76 7.17 -9.49 -1.84 0
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61110 26705754 1 O3N5C18H19 A3B5C18D19 -5.21 9.33 -9.15 -1.18 0
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61111 26705760 1 ClO2N7H14C18 AB2C7D14E18 101.49 7.58 -9.49 -1.34 0
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61112 26705766 2 ON3C9H9 AB3C9D9 29.63 13.72 -9.04 -0.89 0
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61113 26705793 1 ClFN2O3C20H20 ABC2D3E20F20 -140.65 3.97 -9.1 -0.36 0
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61114 26705806 1 SN2O5C21H22 AB2C5D21E22 -130.56 5.48 -8.71 -1.36 0
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61115 26705810 1 NO4C20H21 AB4C20D21 -128.49 2.34 -8.56 0.0 0
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61116 26705811 1 SN2O5C21H22 AB2C5D21E22 -129.49 4.82 -8.67 -1.25 0
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61117 26705820 1 ClFN3O3H13C21 ABC3D3E13F21 -36.33 8.54 -9.09 -1.04 0
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61118 26705827 1 ClFSN2O3C19H20 ABCD2E3F19G20 -140.69 7.91 -9.17 -0.82 0
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61119 26705830 1 ClS2N4O4C20H21 AB2C4D4E20F21 -57.93 4.18 -9.24 -1.02 0
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61120 26705834 1 FSCl2N2O3H17C18 ABC2D2E3F17G18 -140.84 4.82 -9.24 -1.23 0
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61121 26705848 1 O2N4C23H24 A2B4C23D24 4.2 4.67 -8.12 -0.54 0
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61122 26705854 1 N2O4C21H24 A2B4C21D24 -122.12 5.19 -8.28 -0.31 0
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61123 26705864 1 BrClFNOH10C14 ABCDEF10G14 -54.14 4.25 -9.14 -0.88 0
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61124 26705867 1 ClNBr2O3H12C15 ABC2D3E12F15 -73.38 1.02 -9.21 -0.91 0
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61125 26705869 1 BrFNOCl2H7C13 ABCDE2F7G13 -52.7 3.45 -9.22 -1.2 0
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61126 26705875 1 BrNCl2O2H10C15 ABC2D2E10F15 -45.86 1.9 -9.25 -0.82 0
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61127 26705893 1 ClNOF2H10C14 ABCD2E10F14 -102.24 5.22 -8.96 -1.08 0
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61128 26705920 1 NO5C19H19 AB5C19D19 -147.22 3.07 -9.08 -0.65 0
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61129 26705921 1 ClNO4H14C17 ABC4D14E17 -123.08 3.05 -9.3 -0.79 0
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61130 26705925 1 ClN2O4H17C19 AB2C4D17E19 -132.25 5.52 -9.03 -0.92 0
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61131 26705926 1 ClSN2O3H15C19 ABC2D3E15F19 -60.26 3.91 -9.18 -1.71 0
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61132 26705930 1 O4N5H17C18 A4B5C17D18 -26.78 5.15 -9.19 -1.04 0
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61133 26705985 1 SN3O5C14H17 AB3C5D14E17 -205.34 2.97 -9.29 -1.19 0
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61134 26705992 1 FSN2O6H23C25 ABC2D6E23F25 -201.14 7.06 -9.21 -0.96 0
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61135 26705993 1 FSN2O6H23C25 ABC2D6E23F25 -201.54 6.2 -9.18 -0.91 0
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61136 26705997 1 BrFN2O3H16C17 ABC2D3E16F17 -118.87 3.06 -8.33 -1.12 0
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61137 26706023 1 ClSN3O4C22H24 ABC3D4E22F24 -125.91 9.88 -9.27 -0.87 0
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61138 26706034 1 ClSN3O4C21H22 ABC3D4E21F22 -114.68 7.43 -9.44 -0.99 0
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61139 26706041 1 SN2O3C21H22 AB2C3D21E22 -54.07 3.28 -7.95 -1.09 0
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61140 26706089 1 ClO4H15C20 AB4C15D20 -95.18 2.92 -8.71 -0.71 0
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61141 26706106 1 SN3O4H23C24 AB3C4D23E24 -66.75 6.46 -8.14 -0.63 0
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61142 26706108 1 S2N3O3H19C22 A2B3C3D19E22 2.0 3.71 -8.23 -1.28 0
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61143 26706110 1 ClFSN2O3H14C18 ABCD2E3F14G18 -80.01 2.72 -8.29 -1.07 0
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61144 26706115 1 SN2O6C22H24 AB2C6D22E24 -155.26 7.44 -8.48 -0.28 0
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61145 26706116 1 SN3O5C24H27 AB3C5D24E27 -151.52 4.38 -8.07 -0.83 0
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61146 26706118 1 SN3O3H21C22 AB3C3D21E22 -18.11 1.5 -8.25 -0.73 0
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61147 26706119 1 SN2O4H18C20 AB2C4D18E20 -65.48 7.26 -8.49 -0.87 0
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61148 26706126 1 ClN2O2H13C18 AB2C2D13E18 -11.43 3.24 -8.99 -0.91 0
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61149 26706128 1 FO2N4H15C21 AB2C4D15E21 1.49 11.16 -8.7 -1.18 0
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61150 26706129 1 OF3N6H21C22 AB3C6D21E22 -69.65 8.31 -8.94 -0.85 0