B0V7NU -OEChem-04022104323D 29 31 0 0 0 0 0 0 0999 V2000 4.0010 -0.6608 -0.0001 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2961 -2.8737 -0.0123 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2129 0.6951 1.0992 O 0 5 0 0 0 0 0 0 0 0 0 0 -5.1958 0.7448 -1.0954 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6450 0.4816 0.0009 N 0 3 0 0 0 0 0 0 0 0 0 0 1.9027 0.3748 0.0024 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7094 -1.0464 -0.0041 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2802 0.5317 0.0043 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5671 -1.7358 -0.0078 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7903 -1.1594 -0.0058 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0494 -1.6805 -0.0062 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0572 1.4683 0.0065 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8722 1.7814 0.0096 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4226 -0.9212 1.2029 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4039 -0.8672 -1.2124 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6349 2.7413 0.0121 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0322 2.8968 0.0131 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3386 -0.0747 -0.0015 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7061 -0.3751 1.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6873 -0.3209 -1.2104 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5869 -2.8235 -0.0111 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0209 1.3897 0.0072 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9500 1.8976 0.0107 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9397 -1.1507 2.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9062 -1.0545 -2.1601 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9983 3.6222 0.0157 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4607 3.8954 0.0173 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1825 -0.1966 2.1656 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1488 -0.0994 -2.1693 H 0 0 0 0 0 0 0 0 0 0 0 0 1 8 1 0 0 0 0 1 11 1 0 0 0 0 2 11 2 0 0 0 0 3 5 1 0 0 0 0 4 5 2 0 0 0 0 5 18 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 12 2 0 0 0 0 7 9 2 0 0 0 0 7 11 1 0 0 0 0 8 13 2 0 0 0 0 9 10 1 0 0 0 0 9 21 1 0 0 0 0 10 14 2 0 0 0 0 10 15 1 0 0 0 0 12 16 1 0 0 0 0 12 22 1 0 0 0 0 13 17 1 0 0 0 0 13 23 1 0 0 0 0 14 19 1 0 0 0 0 14 24 1 0 0 0 0 15 20 2 0 0 0 0 15 25 1 0 0 0 0 16 17 2 0 0 0 0 16 26 1 0 0 0 0 17 27 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 19 28 1 0 0 0 0 20 29 1 0 0 0 0 M CHG 2 3 -1 5 1 M END $$$$