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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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170450 75235525 1 NOH17C18 ABC17D18 13.89 3.69 -9.1 -0.32 0
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170451 75235886 1 NO2C16H19 AB2C16D19 -47.11 4.01 -9.33 -0.12 0
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170452 75236028 1 BrON3H6C8 ABC3D6E8 53.64 5.29 -9.67 -2.33 0
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170453 75236335 1 O3N6C28H52 A3B6C28D52 -194.59 3.6 -9.29 0.49 0
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170454 75236517 1 N3O3C28H35 A3B3C28D35 -92.62 5.08 -8.63 0.1 0
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170455 75236518 1 SF3N3O3C25H26 AB3C3D3E25F26 -212.81 7.66 -9.85 -2.09 0
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170456 75236519 1 N2O5C32H40 A2B5C32D40 -189.65 4.78 -9.12 -0.46 0
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170457 75236520 1 KPC6H8O8 ABC6D8E8 -441.43 7.63 -9.56 -0.53 0
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170458 75236521 1 RuCl2F2O3N8C43H45 AB2C2D3E8F43G45 85.79 11.44 0.0 0.0 0
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170459 75236522 3 O3C7H12 A3B7C12 -421.74 8.29 -10.0 -0.02 0
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170460 75236523 1 SN2O5C20H26 AB2C5D20E26 -186.59 5.07 -9.26 -0.29 0
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170461 75236524 1 SCl2P3Na4N5C12O12H14 AB2C3D4E5F12G12H14 -914.6 18.07 -8.05 -1.19 0
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170462 75236525 1 SCl2P3N5C12O12H18 AB2C3D5E12F12G18 -613.81 7.2 -8.81 -0.84 0
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170463 75236526 1 S2N5O5C27H43 A2B5C5D27E43 -239.43 2.54 -8.87 -0.22 0
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170464 75237044 1 SN3O6C34H39 AB3C6D34E39 -190.15 7.78 -8.88 -0.67 0
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170465 75237045 1 NO35C63H109 AB35C63D109 -1263.07 5.08 -8.1 -0.42 0
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170466 75237046 2 NO8C25H42 AB8C25D42 -729.1 3.98 -8.4 0.07 0
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170467 75237146 1 O2N3H21C22 A2B3C21D22 -19.88 5.87 -8.65 -0.66 0
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170468 75237253 1 SiO2N3C12H27 AB2C3D12E27 -108.11 2.01 -8.97 -0.13 0
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170469 75237452 1 NO3H17C19 AB3C17D19 -44.71 3.68 -9.92 -0.85 0
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170470 75237653 1 O5N8H46C48 A5B8C46D48 -66.34 7.23 -8.73 -0.49 1
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170471 75237880 1 N4S4O14C40H53 A4B4C14D40E53 -546.73 11.68 0.0 0.0 1
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170472 75237881 1 N3S4O14C41H54 A3B4C14D41E54 -547.1 11.19 0.0 0.0 0
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170473 75237882 1 Cl2N11O24C80H91 A2B11C24D80E91 -755.21 12.97 -8.72 -1.45 0
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170474 75237883 1 N10O23C56H72 A10B23C56D72 -1019.71 10.04 -9.01 -0.75 0