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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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61626 26711236 1 ClSN3O5C18H20 ABC3D5E18F20 -152.76 2.8 -8.77 -1.25 0
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61627 26711241 1 ClN2O3H17C18 AB2C3D17E18 -82.89 3.86 -8.98 -0.29 0
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61628 26711249 2 NO3C11H13 AB3C11D13 -194.12 4.79 -8.64 0.03 0
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61629 26711251 2 NO3C11H13 AB3C11D13 -194.44 4.37 -8.43 -0.23 0
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61630 26711264 1 SO4N5C22H25 AB4C5D22E25 -81.48 3.36 -8.71 -0.63 0
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61631 26711267 1 SN4O5C22H22 AB4C5D22E22 -124.09 5.01 -8.69 -1.02 0
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61632 26711271 1 SN3O5C23H27 AB3C5D23E27 -164.39 5.43 -8.93 -0.5 0
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61633 26711280 1 SN3O5C18H23 AB3C5D18E23 -153.72 4.68 -8.61 -0.84 0
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61634 26711284 1 BrSN3O4C17H20 ABC3D4E17F20 -113.16 1.99 -8.71 -1.37 0
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61635 26711285 1 SN3O5C22H25 AB3C5D22E25 -152.49 7.85 -9.02 -0.97 0
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61636 26711286 1 Cl2S2N3O4C17H19 A2B2C3D4E17F19 -114.62 7.74 -8.39 -1.39 0
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61637 26711287 1 SN3O5C22H25 AB3C5D22E25 -155.39 3.66 -9.0 -0.83 0
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61638 26711298 1 BrSN3O4C19H22 ABC3D4E19F22 -118.68 5.14 -8.72 -1.29 0
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61639 26711299 1 ClSN3O5H22C24 ABC3D5E22F24 -117.71 4.75 -8.64 -1.05 0
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61640 26711309 1 SN3O5C18H23 AB3C5D18E23 -164.54 4.41 -8.62 -0.84 0
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61641 26711310 1 SN3O5C23H27 AB3C5D23E27 -144.12 5.06 -8.98 -0.58 0
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61642 26711316 2 NO2C11H13 AB2C11D13 -128.19 4.4 -8.83 -0.27 0
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61643 26711339 1 SN3O5H17C18 AB3C5D17E18 -103.14 1.87 -8.79 -1.13 0
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61644 26711342 1 SN2O3C20H22 AB2C3D20E22 -77.91 4.04 -8.62 -0.12 0
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61645 26711347 1 SN3O5C17H19 AB3C5D17E19 -126.61 7.76 -8.54 -1.17 0
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61646 26711349 1 F3N4O4C19H19 A3B4C4D19E19 -198.31 8.69 -8.9 -1.22 0
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61647 26711377 1 O2N3H13C16 A2B3C13D16 21.84 2.8 -8.72 -1.33 0
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61648 26711387 1 N3O6C23H23 A3B6C23D23 -148.69 6.28 -8.58 -0.67 0
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61649 26711389 1 N3O5H23C26 A3B5C23D26 -139.56 6.42 -8.71 -1.69 0
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61650 26711390 1 BrSN3O4H16C19 ABC3D4E16F19 -68.22 5.05 -8.74 -1.12 0
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61651 26711412 1 ClSN3O4H18C21 ABC3D4E18F21 -69.03 2.8 -8.77 -1.29 0
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61652 26711441 1 N2O5C24H24 A2B5C24D24 -132.09 2.32 -8.79 -0.34 0
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61653 26711459 1 FSN3O5C22H24 ABC3D5E22F24 -203.29 3.98 -8.84 -0.7 0
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61654 26711514 1 SCl2N3O4H15C19 AB2C3D4E15F19 -89.48 4.71 -8.88 -1.6 0
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61655 26711528 1 SCl2N3O4H15C19 AB2C3D4E15F19 -83.73 5.57 -8.65 -1.48 1
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61656 26711540 1 N2O2C22H31 A2B2C22D31 -50.17 7.14 0.0 0.0 1
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61657 26711542 1 N2O3C21H29 A2B3C21D29 -59.63 3.97 0.0 0.0 0
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61658 26711544 1 SN2O2C15H16 AB2C2D15E16 -35.52 4.26 -8.63 -0.7 1
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61659 26711546 1 BrN2O2C20H26 AB2C2D20E26 -25.07 6.35 0.0 0.0 0
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61660 26711548 2 ON2H6C7 AB2C6D7 4.86 3.44 -8.66 -0.93 0
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61661 26711572 1 N2O4H18C23 A2B4C18D23 -61.35 4.35 -8.6 -1.24 0
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61662 26711575 1 N2O4C17H20 A2B4C17D20 -111.36 5.74 -8.6 -0.27 0
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61663 26711580 1 ClSN3O3C21H28 ABC3D3E21F28 -87.77 10.63 -8.9 -1.19 0
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61664 26711585 1 SN3O5C21H21 AB3C5D21E21 -120.86 4.36 -8.55 -1.01 0
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61665 26711594 1 O2N4H16C21 A2B4C16D21 40.19 3.69 -8.7 -1.36 0
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61666 26711640 1 N3O4H13C14 A3B4C13D14 -35.56 7.18 -8.99 -1.42 0
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61667 26711663 1 ClNO3C20H20 ABC3D20E20 -75.22 3.83 -8.83 -0.67 0
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61668 26711664 1 ClSN2O3C24H31 ABC2D3E24F31 -120.6 8.61 -9.07 -0.27 0
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61669 26711665 1 NSCl2O3H15C16 ABC2D3E15F16 -99.21 3.85 -9.5 -1.13 0
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61670 26711666 1 ClNSO4H18C20 ABCD4E18F20 -96.84 4.61 -9.61 -0.84 0
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61671 26711667 1 BrClSN2O4C19H20 ABCD2E4F19G20 -126.92 6.7 -9.46 -1.43 0
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61672 26711670 1 FCl2N2S2O3C19H21 AB2C2D2E3F19G21 -151.56 3.44 -8.77 -1.25 0
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61673 26711673 1 BrClSN2O3C21H24 ABCD2E3F21G24 -106.75 2.77 -9.48 -1.19 0
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61674 26711677 1 ClSN2O4C19H23 ABC2D4E19F23 -139.71 3.86 -9.42 -0.76 0
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61675 26711682 1 BrClSN2O3C16H16 ABCD2E3F16G16 -81.71 4.16 -9.57 -1.37 0
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61676 26711721 1 ClFSN2O3C20H22 ABCD2E3F20G22 -148.27 2.42 -9.41 -1.08 0
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61677 26711753 1 BrN2O2C16H21 AB2C2D16E21 -88.01 4.15 -9.67 -0.9 0
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61678 26711759 1 FSN2O3C21H25 ABC2D3E21F25 -146.82 3.66 -9.68 -0.97 0
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61679 26711762 1 O2S2N3C22H25 A2B2C3D22E25 -49.02 6.08 -8.58 -0.95 0
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61680 26711764 1 ClNO3C17H24 ABC3D17E24 -133.33 2.01 -8.73 -0.44 0
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61681 26711766 1 SN3O4C17H23 AB3C4D17E23 -89.3 3.87 -9.18 -1.77 0
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61682 26711771 1 S2N3O3C19H27 A2B3C3D19E27 -96.02 4.2 -8.63 -1.35 0
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61683 26711772 1 SN2O3C19H30 AB2C3D19E30 -149.29 6.07 -9.17 -0.16 0
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61684 26711776 1 O2S2N3C19H25 A2B2C3D19E25 -76.14 3.65 -8.6 -1.08 0
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61685 26711781 1 Cl2N2S2O3C18H26 A2B2C2D3E18F26 -137.92 2.58 -8.6 -1.34 0
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61686 26711782 1 Cl2N2S2O3C18H26 A2B2C2D3E18F26 -140.14 3.9 -8.44 -1.4 0
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61687 26711785 1 ClFN2S2O3C18H26 ABC2D2E3F18G26 -181.57 4.39 -8.84 -1.02 0
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61688 26711808 1 BrSN2O4C19H27 ABC2D4E19F27 -167.17 4.96 -9.68 -1.16 0
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61689 26711811 1 NSO2C18H25 ABC2D18E25 -89.11 2.67 -8.67 -0.69 0
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61690 26711823 1 N2S2O5C20H30 A2B2C5D20E30 -201.29 7.11 -8.34 -0.91 0
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61691 26711824 1 SN2O4C23H28 AB2C4D23E28 -114.46 4.88 -8.61 -1.03 0
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61692 26711828 2 NOC9H13 ABC9D13 -107.28 4.48 -9.58 -0.41 0
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61693 26711833 1 N2O3C21H32 A2B3C21D32 -166.05 5.24 -9.65 -0.17 0
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61694 26711837 1 SN2O4C22H34 AB2C4D22E34 -182.98 4.66 -9.22 -0.7 0
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61695 26711840 1 NO2C18H25 AB2C18D25 -99.92 5.42 -9.45 -0.72 0
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61696 26711859 1 SN2O2C17H22 AB2C2D17E22 -91.19 6.12 -8.89 -0.88 0
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61697 26711895 1 Cl2N2S2O5C18H18 A2B2C2D5E18F18 -175.54 5.57 -9.9 -1.43 0
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61698 26711903 2 ClNO2C9H9 ABC2D9E9 -140.78 2.54 -9.15 -0.69 0
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61699 26711910 1 NCl2O4C19H19 AB2C4D19E19 -110.85 1.71 -8.74 -0.61 0
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61700 26711929 1 SN2O4C21H28 AB2C4D21E28 -127.83 8.03 -9.04 -0.28 0