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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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219893 85165016 1 CuN5H35C37 AB5C35D37 319.9 4.45 0.0 0.0 2
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219894 85165017 1 FeOSSnC29H42 ABCDE29F42 169.39 4.04 -7.29 -1.26 0
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219895 85165018 1 N3O16C23H39 A3B16C23D39 -735.82 3.81 -10.1 -0.58 0
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219896 85165019 1 N7O11C25H39 A7B11C25D39 -413.72 5.68 -9.51 -0.89 0
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219897 85165020 1 O4N5C37H39 A4B5C37D39 -43.96 1.94 -8.74 -0.53 0
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219898 85165021 1 SN5O7C30H39 AB5C7D30E39 -275.57 7.39 -9.1 -0.36 0
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219899 85165022 1 SSiN3O10C26H39 ABC3D10E26F39 -413.42 5.3 -8.87 -0.88 0
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219900 85165023 1 MnO2N3C36H54 AB2C3D36E54 4.24 2.62 -6.71 -0.68 0
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219901 85165024 1 NSiO9C32H43 ABC9D32E43 -388.1 3.16 -9.24 -0.13 0
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219902 85165025 1 NSiO4C38H51 ABC4D38E51 -168.49 5.64 -8.88 0.06 0
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219903 85165026 1 Si2N3O5C32H51 A2B3C5D32E51 -250.92 3.43 -8.85 -0.2 0
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219904 85165027 1 ClO3N5H28C36 AB3C5D28E36 26.75 3.75 -8.32 -0.78 0
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219905 85165028 1 SBr2N2O4H18C26 AB2C2D4E18F26 -8.94 8.58 -8.89 -1.67 0
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219906 85165029 2 O2N4H15C17 A2B4C15D17 49.63 2.6 -8.92 -1.29 0
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219907 85165030 1 O3H38C44 A3B38C44 48.99 2.14 -9.36 -0.01 0
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219908 85165031 1 SO6C37H42 AB6C37D42 -157.9 2.13 -9.06 0.18 0
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219909 85165032 1 N2O3C41H46 A2B3C41D46 -43.99 5.24 -8.76 -0.43 0
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219910 85165033 1 SiO6C36H58 AB6C36D58 -376.66 5.92 -8.55 0.29 0
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219911 85165034 1 ClO6C35H63 AB6C35D63 -395.18 5.44 -9.63 -0.62 0
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219912 85165035 1 BrO7C32H39 AB7C32D39 -233.46 3.56 -9.26 -0.33 0
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219913 85165036 1 O5N9C31H37 A5B9C31D37 -102.02 4.59 -9.62 -1.5 0
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219914 85165037 1 SN5O7C30H41 AB5C7D30E41 -301.18 5.17 -8.98 -0.81 0
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219915 85165038 1 NO8C35H53 AB8C35D53 -418.43 5.14 -9.8 -0.23 0
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219916 85165039 1 NSiO6C36H45 ABC6D36E45 -244.07 2.6 -8.86 -0.41 0
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219917 85165040 1 SiN3O7C32H49 AB3C7D32E49 -367.53 3.04 -8.89 -0.32 0