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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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304353 124558498 1 O2N5C18H19 A2B5C18D19 43.4 12.75 -9.55 -1.02 0
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304354 124558508 1 O2N5C18H19 A2B5C18D19 41.41 5.78 -9.5 -1.1 0
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304355 124558521 1 ClSN2O7H27C31 ABC2D7E27F31 -184.48 3.29 -8.9 -1.67 0
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304356 124558522 2 ClNO2H13C17 ABC2D13E17 -41.36 2.81 -9.22 -0.55 0
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304357 124558529 1 ClN2O4H27C34 AB2C4D27E34 -4.21 2.75 -9.18 -0.44 0
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304358 124558654 1 N3O4H29C35 A3B4C29D35 -34.37 4.43 -8.87 -0.43 0
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304359 124558655 1 BrN3O4H26C34 AB3C4D26E34 -1.42 4.14 -8.87 -0.53 0
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304360 124558658 1 BrN3O4H26C34 AB3C4D26E34 -1.8 1.08 -8.87 -0.55 0
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304361 124558683 2 N2O3H10C15 A2B3C10D15 -5.45 8.05 -9.74 -1.53 0
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304362 124558710 1 N4O5H26C37 A4B5C26D37 55.59 1.7 -9.09 -1.58 0
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304363 124558769 1 SO2N4H24C36 AB2C4D24E36 105.44 1.81 -8.79 -0.68 0
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304364 124558855 1 ClSO2N4H21C32 ABC2D4E21F32 82.12 2.15 -8.78 -0.69 0
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304366 124559011 1 ClN2O4H25C33 AB2C4D25E33 4.45 3.5 -8.71 -0.37 0
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304367 124559105 1 SCl2O4N5C26H27 AB2C4D5E26F27 -93.36 6.48 -9.18 -1.12 0
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304368 124559186 1 ISCl2O2N5H20C22 ABC2D2E5F20G22 22.62 5.82 -9.0 -1.18 0
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304369 124559284 1 SCl2O2N6C26H28 AB2C2D6E26F28 11.61 2.01 -8.51 -1.08 0
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304370 124559330 1 SI2N2O2H14C15 AB2C2D2E14F15 34.57 6.49 -9.08 -1.33 0
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304371 124561164 1 ClSN2O5C18H21 ABC2D5E18F21 -171.23 1.73 -8.8 -0.66 0
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304372 124561213 1 ClFSN2O3C18H20 ABCD2E3F18G20 -145.52 5.68 -9.32 -1.03 0
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304373 124561416 1 ClFNO2H15C16 ABCD2E15F16 -100.95 3.26 -9.27 -0.5 0
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304374 124568455 1 SO2N4C16H22 AB2C4D16E22 -26.29 4.11 -8.83 -0.43 0
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304375 124568458 2 NOSC7H11 ABCD7E11 -68.26 6.03 -8.89 -0.24 0
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304376 124568462 1 ClO2N4H15C17 AB2C4D15E17 21.87 4.02 -9.13 -1.22 0
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304377 124568680 1 ClSO2N3C16H16 ABC2D3E16F16 -2.86 5.04 -8.94 -0.94 0
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304378 124570853 1 N2O2C17H22 A2B2C17D22 -49.13 2.61 -9.01 -0.69 0
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304379 124570875 1 ON3C17H19 AB3C17D19 20.07 4.36 -8.89 -0.93 0
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304380 124570909 1 SO2N5C16H21 AB2C5D16E21 -26.15 3.99 -8.65 -0.12 0
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304381 124570915 1 N2O3C18H26 A2B3C18D26 -89.76 3.62 -8.33 -0.15 0
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304382 124570917 1 N5C19H27 A5B19C27 51.96 7.91 -8.94 -0.06 0
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304383 124570924 1 BrN2O3C10H13 AB2C3D10E13 -102.49 5.5 -9.76 -0.48 0
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304384 124571004 1 SN2O3C17H30 AB2C3D17E30 -165.76 2.38 -8.77 0.43 0
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304385 124572623 1 N3O3C17H25 A3B3C17D25 -111.9 1.91 -8.77 0.07 0
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304386 124574960 1 SO2N3C13H17 AB2C3D13E17 -25.4 5.73 -8.81 -1.18 0
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304387 124576109 1 OSN2C13H14 ABC2D13E14 20.61 1.51 -8.7 -0.29 0
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304388 124576574 1 FNO4C15H18 ABC4D15E18 -202.2 6.29 -9.14 -0.51 0
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304389 124576578 1 N3O3C20H25 A3B3C20D25 -89.94 7.6 -9.6 -0.27 0
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304390 124576734 2 NO2C15H25 AB2C15D25 -211.02 4.39 -8.88 -0.35 0
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304391 124576749 1 N3O5H19C22 A3B5C19D22 -85.13 6.62 -8.72 -0.52 0
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304392 124576988 1 ON4C19H26 AB4C19D26 8.43 5.68 -8.64 -0.22 0
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304393 124577158 1 BrNO3C10H20 ABC3D10E20 -167.91 0.93 -8.92 -0.2 0
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304394 124577231 1 O2S2N3C17H17 A2B2C3D17E17 22.43 6.73 -9.11 -1.17 0
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304395 124579475 1 Cl2N3O5H19C23 A2B3C5D19E23 -58.48 7.52 -9.42 -1.57 0
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304396 124579598 1 N3O6C23H25 A3B6C23D25 -187.09 3.38 -8.88 -0.48 0
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304397 124579687 1 ClN3O6H20C21 AB3C6D20E21 -184.98 5.84 -8.86 -0.91 0
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304398 124579876 1 O7H20C24 A7B20C24 -220.34 9.43 -9.91 -1.26 0
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304399 124580847 1 O3N5C23H29 A3B5C23D29 -112.31 8.85 -8.19 -0.62 0
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304401 124580866 1 NO5C30H55 AB5C30D55 -320.98 4.83 -10.11 0.36 0
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304403 124582262 1 O2N3C25H33 A2B3C25D33 -53.41 7.2 -8.12 0.27 0
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304404 124582266 1 ClO2N3C21H24 AB2C3D21E24 -44.57 4.81 -8.53 -0.31 0
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304406 124582678 1 O3N4H18C19 A3B4C18D19 -59.92 7.37 -9.44 -1.02 1