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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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60651 26697343 1 BrNO3C15H20 ABC3D15E20 -112.81 3.83 -8.77 -0.44 0
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60652 26697344 1 SN2O4C20H30 AB2C4D20E30 -179.05 4.25 -9.56 -0.66 0
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60653 26697349 1 ON2C18H22 AB2C18D22 -21.5 3.7 -8.46 -0.73 0
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60654 26697352 1 N2S3O7C19H28 A2B3C7D19E28 -287.3 7.0 -8.55 -2.06 0
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60655 26697355 2 NO2C8H8 AB2C8D8 -44.18 2.32 -9.71 -1.91 0
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60656 26697356 1 SN2O3C15H22 AB2C3D15E22 -114.21 3.63 -8.52 -0.7 0
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60657 26697358 1 ClSN2O3C14H19 ABC2D3E14F19 -124.39 7.28 -9.97 -1.04 0
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60658 26697359 1 NO3C16H21 AB3C16D21 -123.94 5.13 -9.47 -0.57 0
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60659 26697360 1 NO3C16H21 AB3C16D21 -123.93 6.14 -9.4 -0.52 0
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60660 26697361 1 FON3C19H22 ABC3D19E22 -40.54 2.26 -9.06 -0.72 0
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60661 26697362 1 ClFON3C18H19 ABCD3E18F19 -34.87 3.18 -9.26 -0.95 0
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60662 26697363 1 NO3C16H19 AB3C16D19 -95.54 4.77 -8.77 -0.5 0
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60663 26697364 1 NOSC20H23 ABCD20E23 -17.54 2.66 -8.92 -0.16 0
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60664 26697368 1 SN3O3C16H21 AB3C3D16E21 -96.34 9.0 -9.65 -0.87 0
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60665 26697369 1 SN3O4C15H19 AB3C4D15E19 -79.71 7.03 -9.01 -1.52 0
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60666 26697377 1 SN2O3C18H22 AB2C3D18E22 -99.63 6.6 -9.3 -0.96 0
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60667 26697378 1 ClSN2O4C17H23 ABC2D4E17F23 -164.94 3.61 -9.9 -1.09 0
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60668 26697379 1 ClSN2O4C17H23 ABC2D4E17F23 -163.1 7.47 -9.92 -1.09 0
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60669 26697380 1 ClNO3C17H24 ABC3D17E24 -136.29 2.38 -8.81 -0.45 0
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60670 26697381 1 N3O3C14H19 A3B3C14D19 -38.1 9.09 -8.96 -0.95 0
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60671 26697382 1 NSF3O4C14H16 ABC3D4E14F16 -314.09 7.86 -10.18 -1.28 0
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60672 26697389 1 NF2O3C17H21 AB2C3D17E21 -213.65 5.11 -8.99 -0.74 0
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60673 26697390 1 FSN2O2C16H21 ABC2D2E16F21 -136.12 7.1 -8.87 -0.41 0
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60674 26697397 1 Cl2N2S2O3C16H22 A2B2C2D3E16F22 -127.06 6.03 -8.72 -1.31 0
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60675 26697398 1 Cl2N2S2O3C16H22 A2B2C2D3E16F22 -129.33 1.89 -8.78 -1.25 0
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60676 26697399 1 SN2F3O3C16H21 AB2C3D3E16F21 -283.26 5.53 -9.93 -1.04 0
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60677 26697401 1 ClFN2S2O3C16H22 ABC2D2E3F16G22 -174.79 3.65 -8.6 -1.31 0
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60678 26697402 1 ClFN2S2O3C16H22 ABC2D2E3F16G22 -171.65 2.95 -8.88 -1.19 0
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60679 26697403 1 ClN2S2O3C12H17 AB2C2D3E12F17 -105.84 3.28 -9.69 -1.26 0
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60680 26697405 1 BrSN2O3C18H25 ABC2D3E18F25 -129.85 3.04 -9.62 -1.16 0
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60681 26697406 1 BrSN2O3C18H25 ABC2D3E18F25 -128.04 4.64 -9.46 -1.19 0
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60682 26697408 1 SN2O5C16H24 AB2C5D16E24 -193.98 9.94 -9.73 -0.75 0
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60683 26697409 1 ClSN2O3C15H21 ABC2D3E15F21 -133.74 7.7 -9.98 -1.16 0
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60684 26697411 1 SN2O4C17H26 AB2C4D17E26 -176.89 4.98 -9.6 -0.63 0
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60685 26697412 1 BrSN2O3C16H23 ABC2D3E16F23 -133.33 7.4 -9.75 -1.18 0
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60686 26697414 1 NO3C15H21 AB3C15D21 -117.51 2.32 -8.59 -0.2 0
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60687 26697415 1 SN2O3C22H28 AB2C3D22E28 -103.26 5.72 -8.95 -0.78 0
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60688 26697417 1 ClSN2O3C14H19 ABC2D3E14F19 -123.62 4.94 -9.75 -1.0 0
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60689 26697419 2 NOC10H13 ABC10D13 -73.64 4.24 -9.23 -0.3 0
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60690 26697420 1 ClNOF3C15H15 ABCD3E15F15 -192.85 5.33 -9.92 -1.21 0
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60691 26697421 1 NO2F3C15H16 AB2C3D15E16 -225.39 3.82 -9.84 -0.6 0
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60692 26697426 1 SN2O4C17H20 AB2C4D17E20 -115.43 1.62 -9.53 -0.92 0
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60693 26697428 1 NSO5C16H21 ABC5D16E21 -196.58 6.59 -9.41 -0.82 0
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60694 26697429 1 SN2O4C19H28 AB2C4D19E28 -163.96 4.3 -9.22 -0.81 0
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60695 26697438 1 BrSN2O4C17H23 ABC2D4E17F23 -157.57 6.5 -9.67 -1.19 0
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60696 26697441 1 SN2O2C17H24 AB2C2D17E24 -95.12 2.7 -8.64 -0.26 0
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60697 26697443 1 N2S2O5C16H22 A2B2C5D16E22 -198.09 10.38 -10.24 -1.29 0
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60698 26697447 1 NOC15H19 ABC15D19 -31.79 4.08 -9.35 -0.4 0
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60699 26697448 1 ON2C15H16 AB2C15D16 10.08 4.54 -9.82 -1.2 0
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60700 26697449 1 SN2O3C15H22 AB2C3D15E22 -128.21 1.92 -9.9 -0.68 0
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60701 26697451 1 SN2O3C26H28 AB2C3D26E28 -67.07 6.51 -9.5 -0.7 0
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60702 26697453 1 ClSN2O3C21H23 ABC2D3E21F23 -72.21 3.43 -9.44 -0.88 0
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60703 26697454 1 SCl2N2O5C20H22 AB2C2D5E20F22 -177.89 8.74 -8.46 -1.18 0
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60704 26697455 1 SN2O3C21H26 AB2C3D21E26 -103.67 5.74 -9.49 -0.7 0
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60705 26697456 1 N2S2O4C17H26 A2B2C4D17E26 -161.01 3.79 -8.71 -0.48 0
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60706 26697457 1 N2S2O4C17H26 A2B2C4D17E26 -160.66 4.46 -8.65 -0.64 0
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60707 26697458 1 N3O5C15H19 A3B5C15D19 -121.21 6.37 -9.82 -1.52 0
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60708 26697463 1 SN2O3C20H24 AB2C3D20E24 -99.08 4.89 -8.93 -1.01 0
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60709 26697482 1 ClSN2O3C21H23 ABC2D3E21F23 -75.36 7.36 -9.26 -1.18 0
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60710 26697483 1 SN2O4C21H26 AB2C4D21E26 -129.76 3.02 -9.34 -0.68 0
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60711 26697484 1 SN2O4C20H28 AB2C4D20E28 -154.13 4.64 -9.21 -0.81 0
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60712 26697486 1 SN2O3C21H24 AB2C3D21E24 -67.15 5.26 -9.17 -0.89 0
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60713 26697490 1 SN2O6C21H26 AB2C6D21E26 -214.53 2.52 -8.81 -0.85 0
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60714 26697491 1 SN2O6C21H26 AB2C6D21E26 -203.89 4.41 -8.56 -0.64 0
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60715 26697492 1 SN2O4C21H26 AB2C4D21E26 -139.74 8.68 -8.37 -0.85 0
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60716 26697493 1 NO2C16H21 AB2C16D21 -90.12 2.66 -9.69 -0.48 0
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60717 26697497 1 ClN2O2C19H23 AB2C2D19E23 -72.92 4.68 -8.54 -0.7 0
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60718 26697498 1 ClNO3C20H22 ABC3D20E22 -93.72 5.47 -8.68 -0.61 0
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60719 26697499 1 N3O3C14H19 A3B3C14D19 -54.22 8.72 -9.15 -1.12 0
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60720 26697505 1 ClSN2O4C20H23 ABC2D4E20F23 -136.05 9.19 -8.98 -1.14 0
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60721 26697508 1 BrSN2O3C19H21 ABC2D3E19F21 -96.12 2.66 -9.04 -0.96 0
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60722 26697510 1 ClSN3O5C18H18 ABC3D5E18F18 -91.87 5.58 -9.34 -2.13 0
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60723 26697511 1 SN4O4C24H28 AB4C4D24E28 -88.52 7.25 -8.77 -0.74 0
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60724 26697512 1 ClSN2O6C21H25 ABC2D6E21F25 -210.72 11.7 -8.14 -0.81 0
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60725 26697513 1 SN2O5C18H26 AB2C5D18E26 -199.98 4.91 -9.42 -0.75 0
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60726 26697515 1 BrSN2O4C20H23 ABC2D4E20F23 -122.97 2.99 -8.91 -0.91 0
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60727 26697518 1 SN2O3C22H32 AB2C3D22E32 -136.23 3.11 -9.46 -0.82 0
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60728 26697519 1 SN2O3C22H32 AB2C3D22E32 -137.21 2.83 -9.35 -0.79 0
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60729 26697520 1 SN2O3C21H24 AB2C3D21E24 -92.5 5.59 -8.42 -0.93 0
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60730 26697521 1 SN2O3C21H24 AB2C3D21E24 -92.77 1.05 -8.56 -0.88 0
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60731 26697522 1 SCl2N2O3C18H18 AB2C2D3E18F18 -103.25 2.9 -9.18 -1.14 0
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60732 26697523 1 SN2Cl3O3H17C18 AB2C3D3E17F18 -107.38 5.92 -9.14 -1.62 0
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60733 26697524 2 SN2O3C10H15 AB2C3D10E15 -169.26 4.72 -8.85 -1.52 0
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60734 26697525 2 SN2O3C10H15 AB2C3D10E15 -167.49 5.67 -8.95 -1.43 0
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60735 26697526 1 N2S2O7C20H28 A2B2C7D20E28 -284.01 3.24 -9.65 -1.76 0
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60736 26697527 1 SN3O4C19H27 AB3C4D19E27 -164.07 3.41 -9.06 -0.59 1
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60737 26697529 1 SN3O3C23H30 AB3C3D23E30 -62.92 7.14 0.0 0.0 0
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60738 26697530 1 SN3O3C23H29 AB3C3D23E29 -81.43 1.5 -8.96 -0.89 0
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60739 26697531 1 ClSN3O6C19H20 ABC3D6E19F20 -135.57 10.88 -9.45 -1.38 0
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60740 26697533 1 ClSN2F3O3H18C19 ABC2D3E3F18G19 -253.46 4.09 -9.49 -1.19 0
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60741 26697536 1 FSN2O3C17H23 ABC2D3E17F23 -166.0 3.44 -9.44 -1.06 0
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60742 26697537 1 FSCl2N2O3H17C18 ABC2D2E3F17G18 -139.79 6.74 -9.07 -1.62 0
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60743 26697538 1 N2O3C15H20 A2B3C15D20 -121.11 5.35 -9.39 -0.4 0
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60744 26697539 1 SF2N2O3C18H18 AB2C2D3E18F18 -172.5 3.85 -9.52 -1.35 0
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60745 26697542 1 SN2O2C15H18 AB2C2D15E18 -82.44 5.51 -8.87 -0.87 0
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60746 26697544 1 NO4C17H21 AB4C17D21 -153.47 2.64 -9.0 -0.65 0
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60747 26699122 1 SN2O5C23H28 AB2C5D23E28 -158.32 9.54 -8.51 -0.9 0
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60748 26699389 1 SO2N4H14C22 AB2C4D14E22 86.84 1.44 -8.97 -1.53 0
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60749 26699595 1 ClS2N4O4C21H23 AB2C4D4E21F23 -94.54 7.14 -8.9 -1.4 0
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60750 26701067 1 ClN3O4H12C17 AB3C4D12E17 -85.13 7.34 -8.54 -1.27 0