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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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177353 76172554 1 O4C19H24 A4B19C24 -161.7 3.44 -9.27 -0.15 0
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177354 76172555 1 O8C15H18 A8B15C18 -310.9 4.42 -9.68 -0.64 0
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177355 76172556 2 NOC5H6 ABC5D6 -46.34 3.93 -9.22 -0.11 0
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177356 76172557 1 NO6C24H33 AB6C24D33 -162.19 2.9 -8.44 -0.72 0
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177357 76172558 1 N6O7C22H22 A6B7C22D22 -154.03 8.96 -8.92 -2.04 0
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177358 76172559 1 NO7C28H31 AB7C28D31 -180.02 3.83 -8.26 -1.19 0
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177359 76173287 1 FCl2N2H3O4C9 AB2C2D3E4F9 -85.67 3.63 -10.21 -2.19 0
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177360 76173288 1 N2F3O4H5C10 A2B3C4D5E10 -125.26 3.48 -10.07 -1.95 0
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177361 76173380 7 OC3H4 AB3C4 -263.04 3.14 -9.14 -1.31 0
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177362 76174210 1 FN2O4H17C20 AB2C4D17E20 -128.16 9.25 -10.02 -1.7 0
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177363 76175089 1 ClNSH8C13 ABCD8E13 83.64 3.58 -9.42 -1.49 0
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177364 76175293 1 O2N3C14H19 A2B3C14D19 -35.13 5.17 -8.85 -0.01 0
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177365 76175325 1 OCl2N2H12C13 AB2C2D12E13 22.0 7.17 -9.36 -2.22 0
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177366 76175611 1 ON3C15H23 AB3C15D23 -47.41 4.01 -9.27 0.28 0
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177367 76175612 1 ON3C14H23 AB3C14D23 -44.25 6.52 -9.61 -0.77 0
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177368 76175613 1 FON3C14H20 ABC3D14E20 -83.38 2.09 -9.54 -0.42 0
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177369 76175906 1 N3S3O5H19C22 A3B3C5D19E22 -98.83 7.3 -9.4 -2.18 0
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177370 76175990 1 ClN2O5H19C22 AB2C5D19E22 -114.79 10.38 -9.23 -1.8 0
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177371 76176634 1 N3O7C20H21 A3B7C20D21 -154.53 8.88 -10.05 -1.55 0
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177372 76177141 1 BrFN2O3H14C21 ABC2D3E14F21 -79.49 7.04 -9.75 -1.7 0
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177373 76177169 1 FN2O4H19C23 AB2C4D19E23 -113.25 12.26 -9.45 -1.77 0
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177374 76177170 1 FN3O6H16C22 AB3C6D16E22 -123.53 6.74 -10.03 -1.7 -1
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177375 76178226 1 ClNSO5H11C17 ABCD5E11F17 -92.48 7.29 0.0 0.0 0
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177376 76178417 1 SN2O4H36C38 AB2C4D36E38 -81.67 2.19 -8.4 -0.67 0
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177377 76178594 1 ClNO2F3H11C12 ABC2D3E11F12 -247.96 1.2 -10.38 -0.78 0