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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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184995 77239085 1 SN3O3F4C23H27 AB3C3D4E23F27 -272.41 7.84 -8.05 -0.43 0
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184996 77239175 2 ClNO2C15H16 ABC2D15E16 -118.09 3.73 -9.15 -0.87 0
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184997 77239292 1 SF2O3N7C28H39 AB2C3D7E28F39 -155.52 4.0 -8.13 -1.15 0
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184998 77239293 1 ClINO10C29H29 ABCD10E29F29 -379.13 4.1 -8.8 -0.84 0
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184999 77239294 1 NO5C15H23 AB5C15D23 -153.82 1.44 -10.01 -0.73 -1
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185000 77239295 1 NO5C15H22 AB5C15D22 -133.09 3.48 0.0 0.0 0
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185001 77239296 1 NO5C16H25 AB5C16D25 -142.43 7.86 -9.7 -0.33 -1
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185002 77239297 1 NO5C16H24 AB5C16D24 -126.82 3.75 0.0 0.0 0
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185003 77239298 1 ClSF2O3N6C24H31 ABC2D3E6F24G31 -180.63 9.69 -8.44 -1.03 0
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185004 77239299 1 NO2C12H17 AB2C12D17 -67.26 2.62 -9.13 0.22 0
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185005 77239300 1 NO2C16H27 AB2C16D27 -100.84 5.06 -9.17 0.67 0
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185006 77239301 1 NO2C15H25 AB2C15D25 -95.66 4.38 -9.36 0.82 0
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185007 77239647 1 FSN4O4C27H29 ABC4D4E27F29 -123.89 5.9 -9.09 -1.16 0
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185008 77239728 1 SF2N5O5C24H27 AB2C5D5E24F27 -224.92 5.05 -9.07 -1.28 0
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185009 77239729 1 SF2O4N8C31H42 AB2C4D8E31F42 -191.91 6.23 -8.11 -1.06 0
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185010 77239730 2 O3N5C23H28 A3B5C23D28 -164.68 3.17 -9.22 -1.57 0
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185011 77239838 1 NO4C19H29 AB4C19D29 -117.38 8.9 -9.64 -0.28 0
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185012 77239994 1 KO3N4C31H32 AB3C4D31E32 -4.07 4.51 0.0 0.0 0
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185013 77240189 2 O2N4C6H7 A2B4C6D7 -43.73 2.42 -9.76 -3.19 0
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185014 77240190 1 SF2O4N8C31H36 AB2C4D8E31F36 -151.64 9.66 -8.62 -1.17 0
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185015 77240191 1 NO2F3H18C20 AB2C3D18E20 -192.3 1.38 -8.92 -0.75 0
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185016 77240192 1 NaN4O4C32H34 AB4C4D32E34 -41.25 10.28 0.0 0.0 0
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185017 77240430 1 N2O9C11H18 A2B9C11D18 -405.87 7.39 -10.23 -0.3 0
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185018 77240431 1 BrNOC16H20 ABCD16E20 -2.9 4.69 -9.32 -0.07 0
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185019 77240432 1 N2O3C13H18 A2B3C13D18 -124.99 2.9 -9.79 -0.15 0
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185020 77241040 1 SiN3O4C26H37 AB3C4D26E37 -84.9 4.89 -9.19 -1.45 0
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185021 77241596 1 Cl2O3N8C30H30 A2B3C8D30E30 0.35 5.4 -9.3 -1.57 0
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185022 77241622 1 Cl2O4N11H29C30 A2B4C11D29E30 6.46 7.02 -8.6 -1.33 0
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185023 77241623 1 Cl2O5N9C28H29 A2B5C9D28E29 -81.0 10.15 -8.91 -1.49 0
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185024 77241624 2 ClFNOC14H18 ABCDE14F18 -218.63 3.83 -8.87 -0.52 0
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185025 77241625 1 Cl2F2O3N4H28C29 A2B2C3D4E28F29 -178.35 8.12 -9.08 -1.39 0
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185026 77241713 1 Cl2O3N9H29C31 A2B3C9D29E31 40.56 11.91 -9.33 -1.78 -1
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185027 77241850 1 N2S2O8H19C20 A2B2C8D19E20 -244.89 1.51 0.0 0.0 0
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185028 77242091 1 SO2N4C17H20 AB2C4D17E20 -2.2 5.18 -9.16 -0.87 0
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185029 77242092 1 FSSiO3N5C33H36 ABCD3E5F33G36 -85.01 5.44 -8.71 -1.12 0
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185030 77242106 1 ClFO3N5C29H29 ABC3D5E29F29 -106.33 6.39 -8.89 -1.01 0
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185031 77242917 1 ClFO3N5C21H25 ABC3D5E21F25 -118.55 6.64 -8.86 -0.89 0
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185032 77243132 1 ClF3N4O5C20H20 AB3C4D5E20F20 -334.1 7.32 -9.41 -0.87 0
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185033 77243347 1 ClN5O5C23H24 AB5C5D23E24 -174.05 6.01 -9.02 -0.98 0
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185034 77243440 1 NCl2O5C16H21 AB2C5D16E21 -236.52 6.08 -9.47 -0.46 1
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185035 77243652 1 ON2C25H35 AB2C25D35 140.97 3.75 0.0 0.0 0
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185036 77243825 1 F3O3C24H25 A3B3C24D25 -260.62 2.23 -8.84 -0.59 0
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185037 77244604 1 Cl2O2N3C12H15 A2B2C3D12E15 -76.95 4.96 -9.31 -0.52 0
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185038 77244768 1 N5O6C32H51 A5B6C32D51 -257.22 5.11 -8.92 -0.62 0
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185039 77244925 1 O2N5C14H19 A2B5C14D19 11.69 6.56 -8.95 -0.71 0
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185040 77244983 1 ON8C22H22 AB8C22D22 125.91 3.52 -9.37 -1.7 0
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185041 77244984 1 FON8H21C22 ABC8D21E22 77.07 4.02 -9.46 -1.76 0
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185042 77245098 1 ClO2N3C20H24 AB2C3D20E24 -48.59 4.05 -8.62 -0.24 0
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185043 77245126 1 SO4N6C30H34 AB4C6D30E34 -27.31 13.1 -8.75 -1.88 0
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185044 77245328 2 O3N4C23H28 A3B4C23D28 -199.17 4.62 -8.58 -0.71 0