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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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424367 135122416 1 N3O5C25H31 A3B5C25D31 -166.33 5.74 -9.56 -1.46 0
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424368 135122417 1 N4O5C26H34 A4B5C26D34 -189.41 9.21 -9.34 -1.34 0
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424369 135122419 1 N4O5C26H34 A4B5C26D34 -176.37 8.2 -9.57 -1.0 0
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424370 135122420 1 N4O5C25H32 A4B5C25D32 -178.14 3.28 -9.58 -1.04 0
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424371 135122425 1 SO2F3N6C25H25 AB2C3D6E25F25 -130.62 7.62 -8.67 -0.92 0
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424372 135122429 1 IO2N3C15H22 AB2C3D15E22 -45.14 2.09 -9.66 -0.87 0
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424373 135122441 1 ClF3N3O5H17C20 AB3C3D5E17F20 -265.67 4.27 -8.86 -0.86 0
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424374 135122443 1 N4O5C28H38 A4B5C28D38 -199.02 6.51 -9.56 -0.99 0
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424375 135122444 1 N4O5C27H36 A4B5C27D36 -193.61 3.79 -9.54 -1.1 0
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424376 135122455 1 N2O2C9H12 A2B2C9D12 -50.68 4.31 -10.17 -1.31 0
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424377 135122462 1 N3O4C25H33 A3B4C25D33 -150.25 7.51 -9.43 -0.75 0
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424378 135122473 1 FO3C11H13 AB3C11D13 -161.38 0.74 -9.55 -0.64 0
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424379 135122475 2 NOH6C8 ABC6D8 5.83 3.48 -8.79 -1.39 0
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424380 135122477 1 ClN3O4C24H30 AB3C4D24E30 -150.83 4.99 -9.49 -1.06 -1
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424381 135122481 1 N12O14C84H125 A12B14C84D125 -553.79 17.45 0.0 0.0 0
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424382 135122482 2 N6O7C42H63 A6B7C42D63 -630.67 4.75 -9.37 -0.26 0
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424383 135122483 1 N5O5C31H43 A5B5C31D43 -186.32 3.72 -8.74 -0.91 0
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424384 135122485 1 N3O4C20H31 A3B4C20D31 -166.87 2.81 -9.34 -0.34 0
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424385 135122486 1 N4O5C27H36 A4B5C27D36 -188.57 3.63 -9.39 -1.25 0
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424386 135122500 1 N2O3C17H26 A2B3C17D26 -127.84 4.69 -9.67 -0.06 0
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424387 135122506 1 ClFO2C10H10 ABC2D10E10 -128.88 1.91 -10.08 -1.19 0
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424388 135122509 1 SO5C10H20 AB5C10D20 -244.38 3.75 -10.16 0.25 0
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424389 135122513 2 NO2C12H16 AB2C12D16 -115.29 4.64 -9.35 -0.45 0
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424390 135122514 1 ClO3N6C24H29 AB3C6D24E29 -70.76 6.1 -8.51 -1.01 0
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424391 135122518 1 N4O5C28H38 A4B5C28D38 -196.41 9.98 -9.37 -1.12 0