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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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188458 77720320 1 N2C15H28 A2B15C28 -18.2 0.81 -8.22 2.54 0
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188459 77720321 1 N3O5C17H23 A3B5C17D23 -188.32 9.09 -9.94 -0.44 0
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188460 77720358 1 ClF2N3O4C24H24 AB2C3D4E24F24 -218.55 3.73 -8.92 -0.54 0
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188461 77720687 1 N4O5C28H36 A4B5C28D36 -180.82 5.24 -9.24 -0.28 0
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188462 77721142 1 SCl2O3N4H34C36 AB2C3D4E34F36 1.58 4.61 -8.84 -1.01 0
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188463 77721338 2 NO3C9H10 AB3C9D10 -230.78 5.81 -8.6 -0.06 0
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188464 77721658 1 ClN5O6C31H32 AB5C6D31E32 -119.07 5.36 -8.78 -1.94 0
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188465 77721659 1 N3O8C20H35 A3B8C20D35 -422.13 7.44 -9.88 -0.23 0
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188466 77721758 1 ClNO4C23H36 ABC4D23E36 -269.64 5.45 -9.71 0.03 0
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188467 77721825 1 FN2O4C22H33 AB2C4D22E33 -243.03 4.01 -8.89 -0.13 0
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188468 77721876 1 N7O8C48H61 A7B8C48D61 -235.9 10.08 -8.56 -0.95 0
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188469 77722063 1 FN3O5C23H38 AB3C5D23E38 -276.53 4.04 -9.52 -0.14 0
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188470 77722086 1 ON4S5C9H16 AB4C5D9E16 45.91 5.17 -8.75 -1.19 0
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188471 77722087 1 SF2N2O5C21H26 AB2C2D5E21F26 -291.88 4.44 -9.76 -0.77 1
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188472 77722088 1 ON2C27H35 AB2C27D35 72.71 4.04 0.0 0.0 0
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188473 77722134 1 O4N5C25H37 A4B5C25D37 -161.29 5.92 -8.63 -0.03 1
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188474 77722135 1 N6C8H9 A6B8C9 122.77 2.58 0.0 0.0 0
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188475 77722136 1 F3O4N11C27H36 A3B4C11D27E36 -243.4 4.88 -8.66 -1.06 0
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188476 77722378 1 FO2N5C23H28 AB2C5D23E28 -67.13 3.81 -8.79 -0.6 0
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188477 77722379 1 O2N5H7C11 A2B5C7D11 49.05 6.77 -9.39 -2.17 0
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188478 77722658 1 ClFNSO3C18H21 ABCDE3F18G21 -144.38 5.27 -8.96 -0.91 0
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188479 77723248 1 ClNSO4C23H24 ABCD4E23F24 -102.66 9.17 -9.44 -0.44 0
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188480 77723249 1 ClNSO4C31H32 ABCD4E31F32 -88.59 9.41 -9.28 -0.36 0
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188481 77723562 1 SF2N3O5C16H19 AB2C3D5E16F19 -295.68 4.62 -8.91 -0.72 0
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188482 77723563 1 OF2N3C15H19 AB2C3D15E19 -108.69 4.63 -8.86 -0.09 0
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188483 77723564 1 ON4C23H30 AB4C23D30 7.8 3.91 -8.53 -0.43 0
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188484 77723565 1 N4O5C31H36 A4B5C31D36 -172.34 6.02 -9.55 -0.61 0
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188485 77723690 1 O2N4C11H16 A2B4C11D16 -43.05 6.61 -9.37 0.32 0
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188486 77723691 1 N6O6C29H40 A6B6C29D40 -218.35 5.97 -8.76 -0.04 0
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188487 77723735 1 ClNSO5C26H28 ABCD5E26F28 -167.22 9.73 -9.46 -0.58 0
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188488 77723736 1 ClNSO5C32H32 ABCD5E32F32 -128.66 8.66 -9.19 -0.64 0
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188489 77723737 1 O3H16C17 A3B16C17 -58.62 5.14 -8.88 -0.92 0
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188490 77723738 1 ClNSO5C26H28 ABCD5E26F28 -169.07 7.17 -9.48 -0.46 0
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188491 77723739 1 NSCl3O5C24H24 ABC3D5E24F24 -196.88 7.65 -9.52 -1.02 0
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188492 77723740 1 NSCl2O5H23C24 ABC2D5E23F24 -159.43 6.7 -9.54 -0.9 0
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188493 77723741 1 O3H16C17 A3B16C17 -66.72 1.83 -9.39 -0.8 0
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188494 77723742 1 ClSN2O7C33H39 ABC2D7E33F39 -283.92 8.57 -9.64 -0.92 0
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188495 77723946 1 SN3O6C31H37 AB3C6D31E37 -181.4 8.16 -8.77 -0.1 0
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188496 77724080 1 ClN4O9C26H43 AB4C9D26E43 -472.23 8.82 -9.52 -0.71 0
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188497 77724134 1 NSO5C20H21 ABC5D20E21 -147.01 0.47 -8.53 -1.28 0
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188498 77724135 1 NOSC18H19 ABCD18E19 13.68 2.72 -8.34 -0.46 0
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188499 77724136 2 O2C15H18 A2B15C18 -145.99 7.31 -9.2 -0.8 0
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188500 77724137 2 O2C15H17 A2B15C17 -150.07 7.62 -9.32 -0.83 0
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188501 77724250 1 ON7C17H23 AB7C17D23 23.48 3.73 -8.56 -0.6 0
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188502 77724750 1 FSiO3C29H47 ABC3D29E47 -197.77 5.38 -8.65 0.16 0
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188503 77724768 1 FSiO4C34H57 ABC4D34E57 -283.04 1.43 -8.84 0.94 0
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188504 77724867 1 N4O6C27H40 A4B6C27D40 -279.54 2.64 -9.73 -0.34 0
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188505 77725643 1 N3O3C29H35 A3B3C29D35 -56.02 7.7 -9.06 0.02 0
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188506 77725644 2 NOC6H6 ABC6D6 -49.14 1.28 -9.63 -0.7 0
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188507 77725645 1 FS2N3O5C23H28 AB2C3D5E23F28 -213.63 6.23 -8.99 -1.08 0