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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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165542 74563208 1 SN2O2C23H33 AB2C2D23E33 -52.83 2.43 0.0 0.0 1
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165543 74563277 1 ClO3N5C21H25 AB3C5D21E25 39.58 8.52 0.0 0.0 1
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165544 74563297 1 ClON5C20H25 ABC5D20E25 55.95 7.83 0.0 0.0 0
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165545 74563620 1 O3N7C25H35 A3B7C25D35 -38.43 6.32 -8.67 -0.13 1
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165546 74564164 1 BrO2N3C13H15 AB2C3D13E15 -48.08 2.18 0.0 0.0 0
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165547 74564291 1 BrNO2H16C19 ABC2D16E19 -2.28 6.72 -8.98 -1.04 -1
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165548 74564317 1 ClSN3O5H21C24 ABC3D5E21F24 -105.49 6.97 0.0 0.0 1
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165549 74564369 1 ON5C20H24 AB5C20D24 54.03 6.46 0.0 0.0 0
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165550 74564507 1 ClSO3N4H21C26 ABC3D4E21F26 -11.16 8.54 -9.45 -1.03 0
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165551 74565013 1 N3O4H19C23 A3B4C19D23 -1.73 4.78 -9.26 -1.77 0
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165552 74565014 1 N3O4H19C23 A3B4C19D23 -1.67 4.43 -9.35 -1.84 1
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165553 74565670 1 ClON6C20H28 ABC6D20E28 93.46 5.58 0.0 0.0 1
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165554 74565671 1 ClON6C22H32 ABC6D22E32 57.12 5.12 0.0 0.0 1
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165555 74565672 1 O3N6C22H33 A3B6C22D33 21.43 12.63 0.0 0.0 0
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165556 74565926 1 ClFNO4H13C20 ABCD4E13F20 -125.55 7.67 -9.2 -1.54 0
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165557 74566276 1 NCl2O5H19C25 AB2C5D19E25 -97.19 4.18 -8.97 -1.42 0
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165558 74566403 1 NCl2O5H19C25 AB2C5D19E25 -96.38 5.21 -8.35 -1.52 0
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165559 74566404 1 NCl2O4H17C24 AB2C4D17E24 -61.57 4.59 -8.62 -1.59 0
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165560 74566405 1 NCl2O4H19C25 AB2C4D19E25 -71.08 4.61 -8.72 -1.58 -1
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165561 74567007 1 N3O6C25H26 A3B6C25D26 -77.56 7.36 0.0 0.0 1
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165562 74567437 1 NO2C16H22 AB2C16D22 -42.44 5.49 0.0 0.0 0
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165563 74567828 1 O2F3N3C23H26 A2B3C3D23E26 -161.22 4.15 -8.66 -0.79 0
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165564 74568061 2 ON2C16H24 AB2C16D24 -56.16 4.42 -8.35 0.27 1
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165565 74568062 1 O2N3C21H30 A2B3C21D30 -24.33 3.16 0.0 0.0 1
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165566 74568063 1 ON5C22H26 AB5C22D26 71.81 11.25 0.0 0.0 0
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165567 74568064 1 ON5C22H25 AB5C22D25 57.84 6.93 -9.25 -1.28 0
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165568 74568065 1 ON4C21H34 AB4C21D34 -37.78 4.07 -8.78 0.22 0
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165569 74568066 1 SO2N6C20H26 AB2C6D20E26 -12.5 4.16 -9.02 -1.21 1
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165570 74568067 1 FN4C25H34 AB4C25D34 27.17 5.29 0.0 0.0 0
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165571 74568305 2 NO2C7H8 AB2C7D8 -145.78 3.42 -9.5 -1.74 0
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165572 74568308 1 N2O4H12C15 A2B4C12D15 -109.0 3.5 -8.76 -1.86 1
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165573 74568456 1 O2N4C20H25 A2B4C20D25 6.42 11.48 0.0 0.0 -2
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165574 74568653 1 ClSN2O3H9C17 ABC2D3E9F17 45.52 4.41 -9.46 -2.26 -1
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165575 74569554 1 SN3O3F5H11C21 AB3C3D5E11F21 -161.69 4.67 0.0 0.0 2
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165576 74570014 1 O4N5C26H29 A4B5C26D29 1.8 11.53 -6.68 -1.16 0
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165577 74570172 1 OF3N4H11C12 AB3C4D11E12 -112.5 6.83 -8.88 -0.75 -1
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165578 74570289 1 ClNO2H7C12 ABC2D7E12 28.22 4.81 0.0 0.0 1
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165579 74570290 1 SO2N3C13H22 AB2C3D13E22 -40.82 7.6 0.0 0.0 -1
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165580 74570465 1 BrNO2H13C15 ABC2D13E15 17.6 9.16 0.0 0.0 -1
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165581 74570466 1 NS2O4C12H16 AB2C4D12E16 -142.52 4.27 0.0 0.0 0
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165582 74570467 1 SO2N3C9H9 AB2C3D9E9 -29.68 4.17 -9.34 -1.26 -1
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165583 74570468 1 NSO4C8H14 ABC4D8E14 -170.85 3.97 0.0 0.0 -1
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165584 74570469 1 BrNSO4H13C15 ABCD4E13F15 -33.45 4.98 0.0 0.0 1
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165585 74570470 1 ON3C8H18 AB3C8D18 -34.18 3.25 0.0 0.0 0
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165586 74571392 2 NO3C14H18 AB3C14D18 -191.67 20.7 -7.91 -0.32 1
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165587 74571560 1 N4C12H23 A4B12C23 50.25 1.37 0.0 0.0 -1
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165588 74571758 1 N4O4C13H19 A4B4C13D19 -86.13 0.81 0.0 0.0 0
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165589 74572814 1 FOSN3H14C18 ABCD3E14F18 8.69 1.73 -8.56 -0.96 0
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165590 74573066 1 SN2O2C16H16 AB2C2D16E16 -1.69 3.61 -8.93 -1.34 1
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165591 74573673 1 N4C12H17 A4B12C17 89.21 2.35 0.0 0.0 1