D3TO4V_DMYI26 D3TO4V -OEChem-03302104273D 21 21 0 0 0 0 0 0 0999 V2000 1.2333 0.5540 0.7792 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6952 -2.7148 -0.7502 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7958 -2.1843 0.8685 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7813 0.8105 -1.4821 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0857 0.6088 0.4403 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7927 -0.5515 0.1244 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7288 1.8464 0.4133 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1426 -0.4741 -0.2184 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0787 1.9238 0.0706 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7855 0.7636 -0.2453 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1409 -1.8536 0.1477 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1094 0.6715 -0.3113 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5305 0.5996 0.1635 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1851 2.7545 0.6593 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7247 -1.3605 -0.4564 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5797 2.8872 0.0506 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8374 0.8238 -0.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7290 1.4184 0.8593 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2045 0.6969 -0.6924 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7105 -0.3659 0.6426 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2555 -3.5916 -0.7337 H 0 0 0 0 0 0 0 0 0 0 0 0 1 5 1 0 0 0 0 1 12 1 0 0 0 0 2 11 1 0 0 0 0 2 21 1 0 0 0 0 3 11 2 0 0 0 0 4 12 2 0 0 0 0 5 6 1 0 0 0 0 5 7 2 0 0 0 0 6 8 2 0 0 0 0 6 11 1 0 0 0 0 7 9 1 0 0 0 0 7 14 1 0 0 0 0 8 10 1 0 0 0 0 8 15 1 0 0 0 0 9 10 2 0 0 0 0 9 16 1 0 0 0 0 10 17 1 0 0 0 0 12 13 1 0 0 0 0 13 18 1 0 0 0 0 13 19 1 0 0 0 0 13 20 1 0 0 0 0 M END $$$$ DMYI26 -OEChem-03302104273D 20 20 0 0 0 0 0 0 0999 V2000 3.8509 0.4516 0.0012 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5999 1.4041 -0.0018 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5705 -0.7171 0.0001 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2066 -0.4231 -0.0002 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2205 0.9047 0.0004 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7298 -1.4570 -0.0007 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5841 1.1986 0.0002 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0933 -1.1629 -0.0007 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5204 0.1648 -0.0003 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6485 0.1782 0.0009 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9735 -0.5420 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4436 1.7577 0.0012 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4113 -2.4963 -0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8010 -1.7086 0.0001 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9053 2.2370 0.0009 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8180 -1.9726 -0.0008 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0655 -1.1463 -0.9058 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7904 0.1844 0.0288 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0445 -1.1886 0.8802 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9650 1.4176 0.0017 H 0 0 0 0 0 0 0 0 0 0 0 0 1 9 1 0 0 0 0 1 20 1 0 0 0 0 2 10 2 0 0 0 0 3 4 1 0 0 0 0 3 10 1 0 0 0 0 3 14 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 5 7 1 0 0 0 0 5 12 1 0 0 0 0 6 8 2 0 0 0 0 6 13 1 0 0 0 0 7 9 2 0 0 0 0 7 15 1 0 0 0 0 8 9 1 0 0 0 0 8 16 1 0 0 0 0 10 11 1 0 0 0 0 11 17 1 0 0 0 0 11 18 1 0 0 0 0 11 19 1 0 0 0 0 M END $$$$