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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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177910 76250475 1 SO3N5H21C24 AB3C5D21E24 29.54 5.02 -9.11 -1.25 0
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177911 76250476 1 SO2N3C30H31 AB2C3D30E31 -5.37 1.63 -7.9 -0.3 0
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177912 76250477 1 O3N6C20H26 A3B6C20D26 -70.46 6.54 -8.26 -0.47 0
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177913 76250478 1 O2S2N4C23H28 A2B2C4D23E28 -21.29 9.21 -7.99 -1.71 0
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177914 76250737 1 SO3N4C23H26 AB3C4D23E26 -100.42 4.5 -7.77 -0.27 0
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177915 76250849 1 SN3O4C26H27 AB3C4D26E27 -95.02 5.0 -8.8 -1.04 1
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177916 76250884 1 ClO3N4C22H22 AB3C4D22E22 -34.69 8.54 0.0 0.0 0
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177917 76251909 1 SN2O5C18H26 AB2C5D18E26 -187.02 1.89 -9.0 -0.41 0
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177918 76252221 1 ClO2N4C25H27 AB2C4D25E27 -4.23 8.27 -8.43 -0.7 0
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177919 76252222 1 O3N9C23H33 A3B9C23D33 -64.88 10.54 -9.02 -0.67 0
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177920 76252477 2 OSN3C11H11 ABC3D11E11 63.0 5.36 -9.04 -1.54 0
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177921 76252478 1 S2O3N4C21H26 A2B3C4D21E26 -36.26 7.79 -8.96 -1.48 0
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177922 76252479 1 O2N4C27H28 A2B4C27D28 54.34 4.54 -8.81 -0.29 0
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177923 76252501 1 FON4H19C21 ABC4D19E21 39.15 3.2 -8.9 -1.35 0
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177924 76252645 1 FIO3N4H18C19 ABC3D4E18F19 -93.38 3.83 -9.76 -1.45 0
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177925 76252646 1 SO4N6C22H24 AB4C6D22E24 -52.69 5.18 -9.56 -1.33 0
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177926 76253041 1 N2O3C28H28 A2B3C28D28 -21.8 1.71 -9.35 -0.87 0
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177927 76253042 1 SN4O5H18C22 AB4C5D18E22 -24.77 6.87 -9.13 -3.07 0
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177928 76253043 1 SN4O4C18H18 AB4C4D18E18 -16.18 6.21 -8.62 -3.15 0
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177929 76253483 1 O2N4C25H28 A2B4C25D28 -10.47 4.81 -8.69 -0.8 0
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177930 76253494 1 FN5O5C24H26 AB5C5D24E26 -178.68 4.15 -8.71 -1.06 0
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177931 76253495 1 O3N4C20H22 A3B4C20D22 -40.32 2.01 -9.35 -1.46 0
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177932 76253607 1 O4N5C25H33 A4B5C25D33 -116.1 4.8 -9.14 -0.28 0
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177933 76253867 1 N3O3C22H33 A3B3C22D33 -120.0 2.16 -8.76 -0.45 0
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177934 76253887 1 N2O4C21H32 A2B4C21D32 -147.84 4.21 -8.33 -0.32 0
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177935 76254171 1 N5O5C21H25 A5B5C21D25 -213.15 3.51 -9.41 -0.53 0
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177936 76254268 1 S2N3O3C17H23 A2B3C3D17E23 -75.01 7.25 -9.23 -1.71 0
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177937 76254378 1 O3N7C25H33 A3B7C25D33 -68.42 7.68 -8.43 -0.1 0
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177938 76254426 1 SN4O4H20C23 AB4C4D20E23 -22.68 4.41 -9.31 -1.84 0
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177939 76254643 1 BrNF2O4H16C17 ABC2D4E16F17 -167.27 6.68 -8.93 -0.66 0
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177940 76254672 1 N4O5C19H20 A4B5C19D20 -87.78 6.86 -9.47 -1.46 0
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177941 76254756 1 O3N8C16H30 A3B8C16D30 -69.6 8.71 -9.58 -0.2 0
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177942 76254799 1 O2N3H21C24 A2B3C21D24 55.46 4.91 -8.97 -0.73 0
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177943 76255143 1 S2O4N5C23H27 A2B4C5D23E27 -86.85 6.89 -8.96 -1.01 1
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177944 76255154 1 ClSN5O5C21H23 ABC5D5E21F23 -151.54 9.39 0.0 0.0 0
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177945 76255212 1 N2S2O3C24H26 A2B2C3D24E26 -55.41 6.77 -8.87 -0.64 0
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177946 76255257 1 SN3O4C23H27 AB3C4D23E27 -118.13 10.53 -8.49 -0.78 0
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177947 76255549 1 N3O3C23H25 A3B3C23D25 -63.3 10.77 -8.75 -0.86 0
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177948 76256157 2 NO2C11H14 AB2C11D14 -110.78 6.73 -8.57 -0.53 0
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177949 76256830 4 NOC6H7 ABC6D7 -96.74 7.06 -8.63 -1.62 0
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177950 76257237 1 O2S2N5C17H19 A2B2C5D17E19 14.22 8.37 -8.76 -1.85 0
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177951 76257238 1 SN3O3C22H29 AB3C3D22E29 -77.18 6.25 -8.86 -0.53 0
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177952 76257869 1 N3O4C23H23 A3B4C23D23 -49.43 3.34 -8.45 -0.95 0
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177953 76257982 1 ON4C24H32 AB4C24D32 7.57 2.26 -8.71 0.07 0
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177954 76257983 1 SO3N4C25H28 AB3C4D25E28 -42.34 4.16 -8.53 -1.82 0
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177955 76258289 1 SO2N4C22H22 AB2C4D22E22 -2.0 6.46 -8.8 -0.9 0
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177956 76258290 1 N3O3H25C26 A3B3C25D26 -46.94 0.98 -8.75 -0.44 0
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177957 76258405 1 N5O5C20H21 A5B5C20D21 -88.13 4.95 -9.13 -1.91 1
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177958 76258544 1 S2N3O4C23H28 A2B3C4D23E28 -6.09 8.29 0.0 0.0 0
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177959 76258698 1 FN2O3H23C24 AB2C3D23E24 -80.13 5.11 -8.43 -0.53 1