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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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251350 103103359 1 N3O4C12H21 A3B4C12D21 -192.84 7.21 -9.54 0.28 0
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251351 103103385 1 N3O4C12H15 A3B4C12D15 -153.61 11.83 -9.12 -0.58 0
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251352 103103386 1 N3O4C13H17 A3B4C13D17 -163.07 8.88 -9.39 -0.34 0
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251353 103103391 1 N3O5C13H17 A3B5C13D17 -191.15 2.5 -9.25 -0.45 0
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251354 103103393 1 N3O4C14H19 A3B4C14D19 -157.93 4.11 -9.79 -0.21 0
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251355 103103394 1 N3O4C9H15 A3B4C9D15 -163.9 8.83 -9.95 -0.12 0
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251356 103103395 1 N3O5C10H17 A3B5C10D17 -223.47 3.35 -10.09 0.16 0
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251357 103103399 1 N3O4C13H23 A3B4C13D23 -207.32 5.31 -9.72 0.1 0
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251358 103103400 1 N3O4C11H21 A3B4C11D21 -206.44 1.97 -9.62 0.42 0
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251359 103103401 1 N3O5C12H21 A3B5C12D21 -233.98 3.64 -9.8 0.05 0
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251360 103103410 1 N3O4C14H19 A3B4C14D19 -163.41 6.19 -9.62 -0.34 0
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251361 103103417 1 N3O4C14H25 A3B4C14D25 -209.59 7.53 -9.66 0.16 0
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251362 103103422 3 NO2C3H5 AB2C3D5 -260.33 3.58 -10.55 -0.76 0
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251363 103103429 1 N3O4C10H19 A3B4C10D19 -204.11 4.74 -9.94 -0.14 0
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251364 103103438 1 N3O4C9H17 A3B4C9D17 -182.87 3.87 -9.99 0.22 0
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251365 103103447 1 SN3O4C12H21 AB3C4D12E21 -190.74 6.35 -9.78 -0.67 0
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251366 103103459 1 N3O4C11H21 A3B4C11D21 -203.9 5.4 -9.76 0.29 0
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251367 103103465 1 N3O4C13H23 A3B4C13D23 -203.71 6.11 -9.53 0.29 0
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251368 103103466 1 N3O4C13H21 A3B4C13D21 -189.32 3.57 -10.09 -0.1 0
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251369 103103469 1 N3O4C7H13 A3B4C7D13 -179.68 4.7 -9.81 -0.18 0
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251370 103103470 1 ClN3O4C12H14 AB3C4D12E14 -166.26 2.83 -9.37 -1.4 0
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251371 103103472 1 N3O4C13H17 A3B4C13D17 -162.6 11.6 -9.06 -0.55 0
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251372 103103476 2 N2O2C6H11 A2B2C6D11 -179.3 2.85 -9.31 0.4 0
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251373 103103483 1 N3O4C13H23 A3B4C13D23 -196.4 2.99 -9.58 0.48 0
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251374 103103489 1 N3O6C10H17 A3B6C10D17 -274.7 6.4 -10.01 -0.29 0
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251375 103103491 1 N3O4C13H23 A3B4C13D23 -201.34 4.86 -9.87 0.04 0
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251376 103103497 1 N3O4C14H19 A3B4C14D19 -170.38 4.02 -9.24 -0.62 0
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251377 103103500 1 SN3O4C12H21 AB3C4D12E21 -184.19 6.26 -9.78 -0.65 0
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251378 103103508 1 SN4O4C11H16 AB4C4D11E16 -154.52 3.67 -9.85 -1.08 0
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251379 103103543 1 N3O5C13H17 A3B5C13D17 -189.01 2.42 -9.38 -0.64 0
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251380 103103550 1 N3O4C12H19 A3B4C12D19 -175.82 5.75 -9.78 0.27 0
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251381 103103559 1 N4O4C11H14 A4B4C11D14 -144.63 13.06 -9.47 -0.99 0
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251382 103103567 1 FN3O4C12H14 AB3C4D12E14 -205.0 3.19 -9.63 -1.25 0
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251383 103103600 1 N3O4C12H21 A3B4C12D21 -204.89 9.73 -9.87 0.06 0
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251384 103103609 1 BrN3O4C12H14 AB3C4D12E14 -149.5 12.59 -9.12 -0.73 0
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251385 103103618 1 N3O4C11H21 A3B4C11D21 -204.9 5.1 -9.97 -0.16 0
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251386 103103639 1 BrON3C9H12 ABC3D9E12 -23.08 1.47 -9.05 -0.49 0
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251387 103103643 1 FON3C9H12 ABC3D9E12 -65.32 3.07 -9.32 -0.45 0
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251388 103103647 1 ClON7C10H12 ABC7D10E12 40.39 2.88 -9.97 -1.45 0
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251389 103103652 1 BrOSN4C6H9 ABCD4E6F9 4.49 2.9 -9.25 -1.23 0
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251390 103103674 1 ClON4C11H17 ABC4D11E17 -32.8 5.67 -9.3 -0.49 0
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251391 103103676 1 ClON4C8H11 ABC4D8E11 -11.34 2.1 -9.43 -0.78 0
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251392 103103679 1 ClON5C8H12 ABC5D8E12 -20.75 2.4 -9.34 -0.4 0
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251393 103103682 1 ClON4C11H15 ABC4D11E15 -3.23 0.65 -9.45 -0.71 0
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251394 103103687 1 BrON4C12H19 ABC4D12E19 -39.91 2.13 -9.4 -0.59 0
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251395 103103690 1 ClO3N5C8H10 AB3C5D8E10 -9.76 3.46 -9.92 -1.56 0
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251396 103103697 1 ClON6C9H11 ABC6D9E11 22.07 1.81 -9.28 -0.91 0
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251397 103103699 1 BrON4C11H17 ABC4D11E17 -34.3 2.05 -9.43 -0.62 0
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251398 103103700 1 BrON4C8H11 ABC4D8E11 -13.43 1.11 -9.53 -0.83 0
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251399 103103715 1 O3N4C13H24 A3B4C13D24 -107.49 3.37 -9.39 0.3 0