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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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175889 75966228 1 C25H36 A25B36 -11.24 0.87 -8.76 0.33 0
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175890 75966229 2 C13H19 A13B19 -18.9 0.89 -8.85 0.37 0
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175891 75966230 14 C2H3 A2B3 -28.86 0.77 -8.84 0.41 0
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175892 75966231 1 O2N4C17H18 A2B4C17D18 -10.8 8.43 -8.59 -0.9 0
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175893 75966232 1 ClCuSN4C8H9 ABCD4E8F9 120.07 6.1 0.0 0.0 0
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175894 75966233 1 N3O3F6H21C23 A3B3C6D21E23 -413.2 7.74 -9.97 -1.2 0
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175895 75966234 1 N3O3F6H23C24 A3B3C6D23E24 -409.41 4.79 -9.59 -1.26 0
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175896 75966235 1 N2O2F6H18C21 A2B2C6D18E21 -369.59 7.52 -9.72 -1.07 0
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175897 75966236 2 NOF3H10C11 ABC3D10E11 -367.64 8.84 -9.66 -0.91 0
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175898 75966237 1 F3S6O10N13H48C51 A3B6C10D13E48F51 -335.83 17.55 -8.74 -1.88 0
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175899 75966238 1 S6O8N13H47C49 A6B8C13D47E49 -96.32 8.47 -8.66 -1.77 0
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175900 75966493 1 O2N3C22H25 A2B3C22D25 -16.65 1.69 -8.82 -0.75 0
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175901 75966496 1 N3O3C23H27 A3B3C23D27 -49.39 3.17 -8.33 -0.71 0
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175902 75966941 1 ON4C14H14 AB4C14D14 47.09 5.58 -9.19 -1.05 0
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175903 75967127 1 N3O8C32H39 A3B8C32D39 -293.45 10.87 -8.84 -0.43 0
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175904 75967277 1 S2N4O5H32C33 A2B4C5D32E33 -51.23 7.1 -8.72 -1.4 0
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175905 75967278 1 SN2O4H32C33 AB2C4D32E33 -40.48 3.33 -8.54 -0.89 0
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175906 75967279 1 O2N5C25H27 A2B5C25D27 45.2 5.14 -8.83 -1.18 0
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175907 75967294 1 BrSN2O5C18H19 ABC2D5E18F19 -99.9 7.5 -10.32 -1.35 0
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175908 75967295 1 FNO3C21H24 ABC3D21E24 -149.54 4.16 -8.58 -0.63 0
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175909 75967296 1 FNO3C20H22 ABC3D20E22 -143.84 3.93 -8.65 -0.68 0
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175910 75967445 1 O38C45H76 A38B45C76 -1700.84 5.97 -10.32 0.04 0
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175911 75967646 1 S3N25O26C80H119 A3B25C26D80E119 -992.49 32.76 -7.56 -1.87 0
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175912 75967682 1 ClO2S2H17C21 AB2C2D17E21 -0.42 3.28 -8.46 -0.91 0
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175913 75967953 2 NOC10H14 ABC10D14 -82.61 4.77 -8.51 -0.23 0
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175914 75967954 1 OCl2N5C21H21 AB2C5D21E21 23.54 4.11 -9.07 -0.96 0
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175915 75967955 1 OI2N2H22C25 AB2C2D22E25 148.69 51.5 -5.74 -4.0 2
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175916 75967956 1 ON2H22C25 AB2C22D25 150.93 6.84 -4.32 -3.04 0
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175917 75968193 1 O5C21H34 A5B21C34 -273.2 5.19 -9.93 0.78 0
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175918 75968299 1 ClO2N6H11C20 AB2C6D11E20 210.28 4.24 -10.1 -2.41 0
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175919 75968321 1 O2N3C20H23 A2B3C20D23 61.31 6.0 -8.77 -0.46 0
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175920 75968490 1 BrSN3C14H18 ABC3D14E18 43.23 4.83 -8.73 -0.51 0
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175922 75968538 1 N34O34C109H172 A34B34C109D172 -1591.45 6.81 -8.45 -0.28 0
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175923 75968708 1 ON6C21H24 AB6C21D24 44.99 3.27 -8.59 -0.64 0
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175924 75968788 1 O6H20C23 A6B20C23 -174.31 0.98 -9.26 -0.98 0
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175925 75968789 1 ClNO4C16H16 ABC4D16E16 -122.48 6.65 -9.74 -0.76 0
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175926 75968790 2 N2O3C10H17 A2B3C10D17 -298.84 4.28 -9.7 0.4 0
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175927 75969039 1 NO5C33H43 AB5C33D43 -181.88 2.57 -8.56 0.16 0
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175928 75969404 1 BrClSO3H16C22 ABCD3E16F22 -45.89 2.83 -8.91 -1.2 0
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175929 75969405 1 NO3C22H27 AB3C22D27 -68.77 2.34 -8.17 -0.7 0
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175930 75969406 1 N3O4C21H27 A3B4C21D27 -110.95 2.49 -8.56 -0.23 0
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175931 75969407 1 SBr2F3O4H13C22 AB2C3D4E13F22 -217.44 1.46 -10.1 -1.37 0
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175932 75969408 1 N2O2C5H6 A2B2C5D6 -19.64 4.2 -9.72 -1.53 0
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175933 75969409 1 N5O8C45H57 A5B8C45D57 -212.61 7.06 -8.0 -0.46 0
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175934 75969623 1 O5H18C25 A5B18C25 -112.42 6.16 -8.94 -1.79 0
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175935 75969705 1 BFSN6O10C39H46 ABCD6E10F39G46 -440.09 11.08 -9.78 -0.39 0
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175937 75970047 1 N2O3H16C23 A2B3C16D23 12.19 5.38 -8.84 -1.63 0
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175938 75970487 1 P3N6O18C23H31 A3B6C18D23E31 -838.75 18.21 -9.1 -1.62 0
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175939 75970488 1 O21N37C98H177 A21B37C98D177 -1029.07 9.04 -9.13 -0.1 0
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175940 75970489 2 O12N13C52H92 A12B13C52D92 -1313.25 11.04 -8.62 0.16 0