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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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30423 841309 1 ClN2O3C17H17 AB2C3D17E17 -28.4 5.26 -9.24 -1.71 1
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30424 841310 1 N2O3C15H15 A2B3C15D15 -68.71 3.54 0.0 0.0 0
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30425 841311 1 FO2N3H16C17 AB2C3D16E17 -66.76 5.22 -8.85 -0.58 0
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30426 841312 1 OSCl2N2H10C13 ABC2D2E10F13 26.02 3.86 -9.34 -0.92 0
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30427 841321 1 ClOF2N2H9C13 ABC2D2E9F13 -94.37 5.91 -9.07 -0.66 0
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30428 841323 1 NOC19H33 ABC19D33 -101.38 3.54 -9.34 2.99 0
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30429 841326 1 SN3O3H9C16 AB3C3D9E16 19.95 2.27 -8.95 -1.52 0
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30430 841327 1 ON2Cl3H11C14 AB2C3D11E14 -23.34 3.99 -9.19 -0.78 0
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30431 841328 1 O2N4C19H20 A2B4C19D20 46.08 4.18 -8.88 -0.98 0
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30432 841329 1 ClSN2O2H13C14 ABC2D2E13F14 3.5 5.33 -8.5 -1.16 0
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30433 841330 1 O3N5C14H15 A3B5C14D15 39.64 3.08 -8.94 -1.53 0
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30434 841332 1 ON2Cl3H11C14 AB2C3D11E14 -24.8 3.45 -8.89 -0.84 0
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30435 841334 1 FO3N4H11C12 AB3C4D11E12 -37.13 4.1 -9.24 -1.66 0
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30436 841335 1 ON2C16H18 AB2C16D18 -20.56 2.61 -8.69 0.06 0
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30437 841336 1 FON3C13H14 ABC3D13E14 -41.88 5.64 -8.75 -0.25 0
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30438 841337 1 O4N5H13C16 A4B5C13D16 60.39 7.58 -9.75 -1.7 0
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30439 841338 1 NSO4C17H19 ABC4D17E19 -147.03 7.12 -8.68 -0.6 0
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30440 841339 1 OCl2N3H11C12 AB2C3D11E12 1.18 7.04 -9.0 -0.55 0
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30441 841341 1 NOSC14H15 ABCD14E15 -9.69 3.45 -9.1 -0.62 0
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30442 841342 1 ClN2O3C17H17 AB2C3D17E17 -48.81 5.67 -8.66 -0.75 0
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30443 841343 1 NOSC15H21 ABCD15E21 -40.97 4.24 -9.35 -0.56 0
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30444 841344 2 NOC8H12 ABC8D12 -65.18 4.62 -8.93 0.02 0
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30445 841345 1 ClFON3C13H13 ABCD3E13F13 -38.87 6.58 -9.28 -0.1 0
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30446 841346 1 NO3C18H21 AB3C18D21 -97.6 4.1 -8.68 -0.07 0
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30447 841347 1 N5O5C15H17 A5B5C15D17 -29.35 3.24 -8.33 -1.51 0
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30448 841348 1 ClON3C14H16 ABC3D14E16 -4.17 0.59 -8.91 -0.65 0
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30449 841349 1 FO2N4H15C18 AB2C4D15E18 -5.13 2.91 -8.74 -0.74 0
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30450 841350 1 N4O5H14C15 A4B5C14D15 -114.59 4.16 -8.92 -0.7 0
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30451 841351 1 Cl2O3N4H8C11 A2B3C4D8E11 6.36 7.03 -9.96 -1.27 0
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30452 841353 1 NSF3O3H12C15 ABC3D3E12F15 -239.74 3.66 -9.24 -1.3 0
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30453 841354 1 ClON5C17H22 ABC5D17E22 35.48 4.34 -7.91 -0.5 0
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30454 841355 1 ClO3N4C14H15 AB3C4D14E15 -19.48 6.17 -9.29 -0.97 0
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30455 841356 1 ClFOSN2H10C13 ABCDE2F10G13 -11.91 4.03 -9.33 -0.87 0
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30456 841358 1 FH7N8C9 AB7C8D9 141.04 4.2 -9.57 -1.06 0
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30457 841359 1 FNO2H12C13 ABC2D12E13 -95.85 5.83 -8.96 -0.33 0
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30458 841362 1 FON4H17C19 ABC4D17E19 22.96 1.16 -8.64 -0.7 0
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30459 841363 1 N3O3C16H17 A3B3C16D17 -63.72 1.96 -8.72 -0.43 0
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30460 841365 1 ClSN3O4H10C13 ABC3D4E10F13 1.56 8.52 -9.5 -1.51 0
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30461 841366 1 FN2O4C17H17 AB2C4D17E17 -107.76 8.7 -9.37 -1.52 0
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30462 841367 1 FN2O4C17H17 AB2C4D17E17 -106.76 9.88 -9.33 -1.51 0
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30463 841368 1 BrON4C13H13 ABC4D13E13 54.71 1.79 -8.86 -0.88 0
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30464 841369 1 Cl2N3O3H5C10 A2B3C3D5E10 22.89 3.79 -9.99 -1.98 0
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30465 841370 1 FOCl2N3H10C12 ABC2D3E10F12 -44.26 9.96 -8.93 -0.57 0
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30466 841371 1 N4O5C15H18 A4B5C15D18 -76.26 10.79 -8.6 -0.62 0
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30467 841372 1 N3O4C18H19 A3B4C18D19 -81.87 8.08 -8.71 -0.5 0
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30468 841374 1 NO3C18H21 AB3C18D21 -92.36 4.61 -8.43 0.05 0
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30469 841381 1 NO3C11H17 AB3C11D17 -148.76 6.73 -10.07 0.47 0
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30470 841382 1 N3O5C17H17 A3B5C17D17 -95.15 8.37 -9.2 -1.6 0
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30471 841387 1 ON5C11H11 AB5C11D11 76.09 10.02 -9.26 -0.7 0
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30472 841388 1 OSCl2N2C12H14 ABC2D2E12F14 -33.39 7.65 -8.6 -0.58 0