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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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179910 76554036 1 N8O9C35H36 A8B9C35D36 -191.43 9.59 -9.33 -1.74 0
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179911 76554055 1 ClFSN5O5C23H23 ABCD5E5F23G23 -194.45 2.05 -8.53 -0.77 0
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179912 76554056 1 ClFO4N6C27H30 ABC4D6E27F30 -132.74 4.04 -8.36 -0.64 0
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179913 76554298 1 OSi2C16H16F18 AB2C16D16E18 -1044.41 7.27 -10.51 -0.3 0
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179914 76554621 1 O2N3Cl4C25H27 A2B3C4D25E27 -89.75 3.83 -9.42 -0.86 0
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179915 76554958 1 FO4N6C13H17 AB4C6D13E17 -158.12 2.4 -9.2 -0.63 0
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179916 76554959 1 N3O3C27H31 A3B3C27D31 -55.6 3.84 -8.54 -0.6 0
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179917 76555136 1 ClNNaO8H19C21 ABCD8E19F21 -327.66 13.01 -8.86 -1.17 0
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179918 76555137 1 ClN2O10C28H29 AB2C10D28E29 -378.62 1.36 -7.98 -0.66 0
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179919 76555138 1 O3N4C22H24 A3B4C22D24 -48.91 3.9 -9.09 -0.81 0
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179920 76555221 1 ClO2N4H17C19 AB2C4D17E19 73.16 10.76 -9.46 -1.32 0
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179921 76555674 1 NaS2N7O24C72H114 AB2C7D24E72F114 -986.13 7.09 -7.7 -0.31 0
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179922 76556574 1 S2O3N5H19C25 A2B3C5D19E25 62.59 8.1 -9.21 -2.8 0
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179923 76556983 1 N2O4C35H40 A2B4C35D40 -104.21 6.32 -8.61 -0.47 0
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179924 76557293 1 O4N7C34H47 A4B7C34D47 -141.03 5.9 -8.18 -0.12 0
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179925 76557693 1 S3N8O13H18C19 A3B8C13D18E19 -183.88 5.67 -8.92 -2.0 1
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179926 76557826 1 O3N7C25H30 A3B7C25D30 -2.1 5.59 0.0 0.0 1
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179927 76557827 1 O3N7C30H32 A3B7C30D32 30.34 4.63 0.0 0.0 1
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179928 76557828 1 O2N6C31H33 A2B6C31D33 62.26 7.64 0.0 0.0 1
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179929 76557829 1 O2N8C29H31 A2B8C29D31 81.64 6.23 0.0 0.0 1
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179930 76557830 1 O3N8C26H31 A3B8C26D31 -4.02 5.33 0.0 0.0 0
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179931 76557922 1 FO2N5C30H38 AB2C5D30E38 -86.03 6.86 -9.13 -0.49 0
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179932 76558125 1 ClNOPTiC27H33 ABCDEF27G33 64.83 24.06 -5.11 -2.99 0
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179933 76558192 1 BrMgF3H8C13 ABC3D8E13 -52.36 4.62 -8.58 -1.04 0
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179934 76558238 1 BrMgNC17H20 ABCD17E20 3.34 4.34 -7.93 0.08 0