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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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193439 78395242 1 FON7H10C18 ABC7D10E18 116.41 8.17 -10.16 -2.54 -1
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193440 78395299 1 SO2H9C10 AB2C9D10 7.62 3.82 0.0 0.0 -1
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193441 78395317 1 N3O5H14C15 A3B5C14D15 -127.83 25.04 0.0 0.0 0
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193442 78395318 1 O10C23H30 A10B23C30 -412.05 7.9 -9.04 -0.75 0
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193443 78395319 1 BrNOH18C23 ABCD18E23 90.85 7.65 -8.38 -1.65 0
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193444 78395343 1 N5O5H13C16 A5B5C13D16 -78.3 4.04 -9.96 -2.45 0
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193445 78396013 1 FN3O4H22C27 AB3C4D22E27 -77.72 7.03 -8.8 -1.15 0
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193446 78396014 1 SN4O4C24H24 AB4C4D24E24 -61.91 3.28 -8.8 -1.11 0
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193447 78396015 1 ClSN4O4C22H25 ABC4D4E22F25 -98.1 5.66 -9.0 -1.44 0
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193448 78396016 1 O3N4H14C17 A3B4C14D17 84.29 4.0 -8.48 -1.44 0
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193449 78396152 1 FO3N4C16H17 AB3C4D16E17 -57.17 3.18 -9.27 -0.95 -1
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193450 78396194 1 SCl2N2O4H13C18 AB2C2D4E13F18 -39.27 20.3 0.0 0.0 0
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193451 78396855 1 Cl2N3O3H15C17 A2B3C3D15E17 -54.82 4.19 -8.78 -1.32 -1
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193452 78396867 1 FO4C12H12 AB4C12D12 -146.13 7.55 0.0 0.0 -1
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193453 78397191 1 N2O7H15C18 A2B7C15D18 -108.45 6.29 0.0 0.0 0
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193454 78397192 1 ON3C21H23 AB3C21D23 65.66 9.46 -8.24 -1.32 2
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193455 78397193 2 ON3C10H12 AB3C10D12 45.64 9.07 -8.73 -1.32 1
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193456 78397506 1 NO5C21H28 AB5C21D28 -135.59 4.75 0.0 0.0 0
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193457 78397669 1 ON6H18C19 AB6C18D19 108.22 2.26 -9.04 -1.01 0
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193458 78397898 1 O2N5H19C22 A2B5C19D22 116.39 6.01 -8.43 -1.5 0
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193459 78397912 1 F3N3O3H18C19 A3B3C3D18E19 -221.34 10.05 -9.49 -0.98 0
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193460 78397913 1 Cl2N3O3H23C25 A2B3C3D23E25 -29.71 2.1 -8.53 -0.69 0
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193461 78397914 1 ON4H20C23 AB4C20D23 122.46 5.27 -8.36 -1.37 0
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193462 78397915 1 O2N5H17C22 A2B5C17D22 158.79 2.97 -8.67 -1.69 0
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193463 78397916 1 FSN3O3C17H22 ABC3D3E17F22 -158.55 3.59 -9.11 -0.34 0
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193464 78397917 1 ON5H19C24 AB5C19D24 156.87 5.68 -8.49 -1.55 -1
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193465 78398300 1 N4O4H15C18 A4B4C15D18 48.65 6.17 0.0 0.0 0
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193466 78398323 1 SF3O3N4C23H25 AB3C3D4E23F25 -218.09 4.94 -8.83 -0.61 1
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193467 78398715 1 ClOSN4H22C23 ABCD4E22F23 73.08 2.95 0.0 0.0 0
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193468 78398830 1 N4O6C23H26 A4B6C23D26 -114.15 10.27 -9.36 -2.09 -1
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193469 78398831 3 NO2H6C7 AB2C6D7 -49.2 10.21 0.0 0.0 -1
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193470 78398832 3 NO2H6C7 AB2C6D7 -49.41 9.6 0.0 0.0 1
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193471 78398833 1 FO3N4C25H26 AB3C4D25E26 8.45 24.61 0.0 0.0 0
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193472 78398834 1 FO3N4C25H25 AB3C4D25E25 -29.02 2.87 -8.44 -1.3 1
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193473 78398835 1 N4O5C16H21 A4B5C16D21 -49.11 4.31 0.0 0.0 0
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193474 78398836 1 ON4C28H32 AB4C28D32 60.95 4.86 -8.04 -0.14 0
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193475 78398876 1 SF3N3O3C16H16 AB3C3D3E16F16 -180.75 11.56 -8.83 -1.28 0
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193476 78399130 1 N3O5H23C24 A3B5C23D24 -85.7 7.66 -9.25 -1.87 0
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193477 78399131 1 N3O4H13C18 A3B4C13D18 -4.16 8.92 -9.38 -1.88 0
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193478 78399132 1 ClSN3O3C20H22 ABC3D3E20F22 -77.69 6.38 -8.9 -0.54 0
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193479 78399133 1 N4O5H18C23 A4B5C18D23 -8.89 9.67 -8.8 -1.91 0
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193480 78399134 1 N3O4C21H25 A3B4C21D25 -116.09 9.42 -9.12 -0.35 0
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193481 78399235 1 Cl2N2O5H16C20 A2B2C5D16E20 -103.19 3.39 -9.2 -0.92 0
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193482 78399236 1 O2N5C19H19 A2B5C19D19 15.76 10.68 -9.18 -0.62 -1
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193483 78399586 1 SN3O6H12C14 AB3C6D12E14 -53.09 9.12 0.0 0.0 0
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193484 78399658 1 ClON2H13C16 ABC2D13E16 53.15 5.76 -9.28 -0.68 -1
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193485 78399659 1 ClN3O4H9C14 AB3C4D9E14 15.94 9.77 0.0 0.0 0
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193486 78399660 1 O2N3H17C18 A2B3C17D18 2.92 7.46 -8.76 -0.97 0
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193487 78399661 1 O2N3C19H19 A2B3C19D19 -0.17 7.33 -8.76 -1.0 0
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193488 78399662 1 SN3O3C20H23 AB3C3D20E23 -28.94 2.26 -8.94 -1.03 0