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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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181387 76740938 1 Cl2N4O4C25H30 A2B4C4D25E30 -148.68 3.75 -8.73 -0.86 0
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181388 76740995 1 ClO2N4C22H27 AB2C4D22E27 -43.65 5.57 -8.97 -0.59 0
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181389 76740996 1 ClON4C18H21 ABC4D18E21 4.49 4.98 -8.76 -0.58 0
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181390 76740997 1 BrON2C13H19 ABC2D13E19 -46.54 3.68 -8.81 -0.2 0
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181391 76740998 1 ClFON4C24H24 ABCD4E24F24 -18.04 0.95 -8.78 -0.68 0
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181392 76741403 1 FSN4O4C26H29 ABC4D4E26F29 -123.34 5.37 -8.56 -0.88 0
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181393 76742186 1 FeSN5O5C44H48 ABC5D5E44F48 190.57 11.52 0.0 0.0 0
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181394 76742324 2 O2C21H31 A2B21C31 -207.97 2.04 -9.1 -0.84 0
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181395 76742533 2 OC7H13 AB7C13 -134.26 1.91 -10.07 1.03 0
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181396 76742736 1 F2N5O5C37H49 A2B5C5D37E49 -258.14 6.48 -8.37 -0.27 0
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181397 76742780 1 N2O7C22H30 A2B7C22D30 -296.45 5.44 -9.0 -0.18 0
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181398 76743050 1 OF2N3C7H7 AB2C3D7E7 -68.74 3.72 -8.86 -0.45 0
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181399 76743051 1 FN2O8C29H33 AB2C8D29E33 -356.0 7.93 -9.46 -0.56 0
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181400 76743052 1 N5O6C29H33 A5B6C29D33 -162.45 9.13 -9.0 -0.62 0
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181401 76743053 1 FN3O8C20H24 AB3C8D20E24 -347.47 5.67 -9.53 -0.84 0
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181402 76743166 1 O3C25H42 A3B25C42 -126.36 5.63 -8.99 1.21 1
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181403 76743326 1 SN4O6C39H49 AB4C6D39E49 -205.07 7.19 0.0 0.0 0
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181404 76743957 1 BrO2N5C13H14 AB2C5D13E14 0.78 4.29 -9.11 -0.97 0
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181405 76744063 1 O2N3C21H27 A2B3C21D27 -65.93 0.86 -9.23 -0.78 0
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181406 76744239 1 ON2H28C29 AB2C28D29 36.43 4.94 -9.01 -0.61 0
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181407 76744240 1 N2O2C23H24 A2B2C23D24 -22.56 6.05 -8.37 -0.63 0
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181408 76744518 1 F2O3N6C31H32 A2B3C6D31E32 -92.33 11.97 -8.85 -0.73 0
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181409 76744519 1 ClFSN3O4C25H31 ABCD3E4F25G31 -182.41 5.97 -8.96 -0.25 0
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181410 76744520 1 SF3O3N6C29H29 AB3C3D6E29F29 -133.03 11.3 -9.08 -0.95 0
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181411 76745216 1 ClNO2H26C29 ABC2D26E29 -2.87 4.4 -9.12 -1.06 0