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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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231345 87573515 1 NSiO4C20H33 ABC4D20E33 -222.53 4.03 -9.01 -0.1 0
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231346 87573516 1 NSiO4C20H32 ABC4D20E32 -174.34 5.02 0.0 0.0 0
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231347 87573517 1 S2F3N3O3H14C16 A2B3C3D3E14F16 -172.45 4.24 -8.0 -0.73 0
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231348 87573523 1 ClNO2F3H7C10 ABC2D3E7F10 -201.37 4.29 -10.48 -1.76 0
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231349 87573525 1 SiO4C15H20 AB4C15D20 -204.88 5.96 -8.87 -0.29 0
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231350 87573527 1 SN3O3F4H23C27 AB3C3D4E23F27 -191.82 9.22 -9.12 -1.1 1
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231351 87573529 1 ClSO2N3H13C18 ABC2D3E13F18 6.63 4.03 0.0 0.0 0
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231352 87573530 1 O2C13H20 A2B13C20 27.49 1.92 -8.31 0.54 0
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231353 87573531 1 OC9H16 AB9C16 -40.93 2.51 -8.26 0.68 0
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231354 87573537 2 ClNOC3H7 ABCD3E7 -46.52 2.98 -8.34 -1.04 0
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231355 87573539 1 NCl2C6H13 AB2C6D13 -42.95 2.35 -9.51 0.22 0
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231356 87573544 2 O3C4H6 A3B4C6 -141.4 2.0 -9.57 -1.49 0
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231357 87573546 2 BrNO2H12C16 ABC2D12E16 -93.11 0.35 -9.37 -2.82 0
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231358 87573547 1 ClN2O5C24H29 AB2C5D24E29 -173.5 2.44 -9.34 -1.09 0
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231359 87573548 1 N3O4C14H15 A3B4C14D15 -87.93 0.53 -8.67 -1.3 0
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231360 87573549 1 ClPC18H40 ABC18D40 -71.06 69.77 -5.07 -1.2 0
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231361 87573551 1 ClPC18H40 ABC18D40 -34.85 54.92 -5.43 -1.58 0
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231362 87573553 3 OC7H14 AB7C14 -224.21 0.35 -10.78 0.28 1
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231363 87573555 1 PN4C12H28 AB4C12D28 22.61 8.97 0.0 0.0 1
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231364 87573556 1 PN3C12H25 AB3C12D25 25.19 11.2 0.0 0.0 0
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231365 87573557 1 SK2H4O7C8 AB2C4D7E8 -380.73 7.27 -9.38 -0.71 0
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231366 87573558 1 KSH6O7C8 ABC6D7E8 -326.32 9.05 0.0 0.0 0
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231367 87573560 1 SCl2N4F5O5H31C32 AB2C4D5E5F31G32 -378.51 3.92 -9.54 -1.17 0
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231368 87573561 1 SH3N3C6O6 AB3C3D6E6 24.39 3.44 -10.05 -2.84 1
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231369 87573563 1 SN3H4C6O6 AB3C4D6E6 6.22 3.77 0.0 0.0 0