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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
Show
33689 7887509 1 FNO4C20H22 ABC4D20E22 -189.12 6.12 -8.51 -1.0 0
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33690 7887514 1 FN2O4H17C19 AB2C4D17E19 -132.72 6.1 -9.7 -0.7 0
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33691 7887515 1 ClSN2O5C18H25 ABC2D5E18F25 -204.72 6.29 -9.38 -1.12 0
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33692 7887517 1 BrFNO4H13C16 ABCD4E13F16 -164.07 7.71 -9.05 -1.1 0
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33693 7887522 1 FOS2N3C18H18 ABC2D3E18F18 -22.13 4.5 -8.82 -1.04 0
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33694 7887527 1 OS2N3H21C23 AB2C3D21E23 50.57 2.74 -8.75 -0.97 0
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33695 7887528 1 FNCl2O4H12C16 ABC2D4E12F16 -183.78 7.13 -9.05 -1.09 0
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33696 7887534 1 FNO5C18H18 ABC5D18E18 -211.77 5.89 -8.38 -0.89 0
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33697 7887537 1 OCl2S2N3H13C16 AB2C2D3E13F16 7.09 1.45 -8.87 -1.07 0
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33698 7887538 1 OCl2S2N3H13C16 AB2C2D3E13F16 9.11 3.24 -9.04 -1.25 0
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33699 7887539 1 FNO4C22H24 ABC4D22E24 -180.23 4.27 -9.3 -0.81 0
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33700 7887540 1 OS2N3C20H23 AB2C3D20E23 1.02 3.3 -8.92 -1.14 0
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33701 7887541 1 FNO4H16C18 ABC4D16E18 -159.58 2.52 -8.72 -0.65 0
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33702 7887550 1 BrON2S3H11C14 ABC2D3E11F14 49.18 1.65 -8.78 -1.19 0
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33703 7887551 1 FNO4C15H18 ABC4D15E18 -207.82 6.05 -9.7 -0.92 0
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33704 7887554 1 FNO4C18H18 ABC4D18E18 -183.19 7.81 -8.35 -1.0 0
Show
33705 7887555 1 OS2N3C19H21 AB2C3D19E21 32.25 5.45 -8.42 -0.67 0
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33706 7887556 1 SN2O4C22H26 AB2C4D22E26 -130.72 3.64 -9.19 -0.62 0
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33707 7887582 1 FNSO4H16C17 ABCD4E16F17 -167.24 7.05 -8.6 -1.05 1
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33708 7887583 1 N2O2C18H27 A2B2C18D27 -65.6 4.4 0.0 0.0 0
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33709 7887588 1 FNO6H16C18 ABC6D16E18 -251.27 6.94 -9.26 -0.87 0
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33710 7887608 1 FN2O6H17C18 AB2C6D17E18 -190.33 6.65 -9.18 -1.12 0
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33711 7887609 1 O2N4S4C15H16 A2B4C4D15E16 -15.49 4.1 -9.03 -1.4 0
Show
33712 7887660 1 FNSO6C19H20 ABCD6E19F20 -261.03 5.2 -9.2 -0.82 0
Show
33713 7887663 1 FNO5C13H16 ABC5D13E16 -235.23 6.88 -9.71 -0.95 0
Show
33714 7887665 1 FNO4C14H18 ABC4D14E18 -211.87 5.38 -9.73 -0.93 0
Show
33715 7887670 1 ON3S3C19H21 AB3C3D19E21 6.43 2.85 -8.77 -0.98 0
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33716 7887698 1 OS2N3C21H23 AB2C3D21E23 4.18 4.96 -8.74 -0.89 0
Show
33717 7887703 1 FN2O5C14H15 AB2C5D14E15 -221.54 5.78 -9.94 -1.06 0
Show
33718 7887706 1 SN2O4C21H32 AB2C4D21E32 -174.49 5.93 -9.36 -0.94 0
Show
33719 7887712 1 FO4C19H19 AB4C19D19 -180.69 1.53 -9.14 -0.55 0
Show
33720 7887715 1 OS2N3C19H25 AB2C3D19E25 -31.83 2.08 -8.57 -0.78 0
Show
33721 7887757 1 FNO5C19H20 ABC5D19E20 -215.36 8.0 -8.98 -0.82 0
Show
33722 7887761 1 N2O2S2C15H18 A2B2C2D15E18 -62.86 0.5 -8.68 -0.85 0
Show
33723 7887766 1 FNO4C17H18 ABC4D17E18 -176.69 3.75 -8.74 -0.35 0
Show
33724 7887769 1 FN2O5C12H13 AB2C5D12E13 -238.01 5.32 -9.88 -1.04 0
Show
33725 7887770 1 FNO5C21H22 ABC5D21E22 -220.52 8.34 -9.3 -0.77 0
Show
33726 7887777 1 FNO4C19H24 ABC4D19E24 -209.35 5.95 -9.06 -0.92 0
Show
33727 7887779 1 FNO6H18C19 ABC6D18E19 -245.35 6.63 -8.33 -0.94 0
Show
33728 7887780 1 FOS2N3C21H22 ABC2D3E21F22 -37.2 2.7 -8.7 -0.91 0
Show
33729 7887784 1 FNO6H18C19 ABC6D18E19 -245.14 6.18 -8.29 -0.93 0
Show
33730 7887786 1 N2O2C27H30 A2B2C27D30 -14.0 3.9 -8.71 0.03 0
Show
33731 7887803 2 OSN2C9H12 ABC2D9E12 -78.34 4.5 -8.49 -0.68 0
Show
33732 7887815 1 OS2N5C19H23 AB2C5D19E23 21.96 7.6 -8.77 -1.1 0
Show
33733 7887818 1 FNO4C15H20 ABC4D15E20 -216.81 8.27 -9.72 -0.95 0
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33734 7887819 1 NOF2C15H19 ABC2D15E19 -144.62 2.57 -9.74 -0.83 0
Show
33735 7887820 1 ClFN2O4H12C17 ABC2D4E12F17 -142.89 11.24 -9.4 -1.26 0
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33736 7887822 1 NOF2C15H19 ABC2D15E19 -144.85 3.33 -9.71 -0.72 0
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33737 7887824 1 OS2N5C19H23 AB2C5D19E23 30.92 7.14 -8.78 -1.06 0
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33738 7887832 1 OS2N5C20H25 AB2C5D20E25 28.28 6.22 -8.74 -1.32 0
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33739 7887905 1 BrFO4H14C17 ABC4D14E17 -158.63 6.34 -9.79 -0.89 0
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33740 7887910 1 FN2O5C18H23 AB2C5D18E23 -266.85 4.97 -9.71 -0.96 0
Show
33741 7887911 1 ClFN2O5H18C19 ABC2D5E18F19 -214.02 3.39 -8.94 -0.7 0
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33742 7887912 1 OS2F3N3C14H14 AB2C3D3E14F14 -164.71 4.37 -8.88 -1.17 0
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33743 7887916 1 OS2N4H18C20 AB2C4D18E20 44.76 5.23 -8.53 -1.14 0
Show
33744 7887923 1 FNO4C19H20 ABC4D19E20 -156.81 4.28 -8.7 -0.4 0
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33745 7887924 1 ON3S3H15C18 AB3C3D15E18 72.09 2.42 -8.58 -0.96 0
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33746 7887925 1 FN2O5H19C20 AB2C5D19E20 -152.83 3.82 -8.94 -0.5 0
Show
33747 7887927 1 S2N3H15C18 A2B3C15D18 98.44 3.97 -8.66 -0.94 0
Show
33748 7887930 1 N2O2S2C15H18 A2B2C2D15E18 -57.79 0.62 -8.63 -0.91 0
Show
33749 7887935 1 S2N3O3H17C19 A2B3C3D17E19 19.03 4.04 -8.74 -1.46 0
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33750 7887937 1 OS3N4H14C17 AB3C4D14E17 69.17 6.76 -8.9 -1.16 0
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33751 7887938 1 BrFO5H12C16 ABC5D12E16 -185.11 3.45 -8.91 -0.61 0
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33752 7887939 1 FNSO4H12C16 ABCD4E12F16 -121.41 4.13 -9.18 -0.89 0
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33753 7887947 1 OS2N3C16H21 AB2C3D16E21 -22.6 2.24 -8.71 -1.02 0
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33754 7887948 1 OS2N4C16H18 AB2C4D16E18 73.26 4.3 -8.45 -1.03 0
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33755 7887952 1 FN2O5H19C20 AB2C5D19E20 -191.59 7.02 -9.02 -0.73 0
Show
33756 7887955 1 FNSO4H16C19 ABCD4E16F19 -129.47 3.81 -8.69 -0.7 0
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33757 7887956 1 S2N3C14H15 A2B3C14D15 64.15 4.48 -8.62 -0.88 0
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33758 7887962 1 OS2N5C18H19 AB2C5D18E19 60.53 4.48 -9.05 -1.41 0
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33759 7887963 1 ClFNO4H17C18 ABCD4E17F18 -184.89 4.09 -9.44 -0.96 0
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33760 7887969 1 FNO5C20H24 ABC5D20E24 -224.81 7.55 -8.77 -0.32 0
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33761 7887977 1 OS2N3C21H23 AB2C3D21E23 9.36 4.24 -8.74 -1.0 0
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33762 7887988 1 N2S2O3H16C18 A2B2C3D16E18 -48.85 1.5 -8.61 -0.9 0
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33763 7888007 1 S2N3O3C15H17 A2B3C3D15E17 -95.11 3.1 -8.57 -0.83 0