B4UXB2 -OEChem-04022108303D 17 18 0 0 0 0 0 0 0999 V2000 -3.1828 0.6228 -0.1635 S 0 0 0 0 0 0 0 0 0 0 0 0 3.5909 0.5020 -0.8164 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8224 1.5555 0.0301 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5169 -0.8982 -0.1875 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4933 -0.0012 0.2719 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7820 0.7084 0.0843 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5786 1.0650 0.2434 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1914 -0.7383 -0.0439 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1094 -1.3578 0.1517 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2242 -1.7712 -0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9475 0.3130 0.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8912 2.0992 0.3353 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8774 -2.1307 0.1803 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4870 -2.8188 -0.0981 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0892 1.2198 1.0363 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4633 -0.4946 0.9694 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1922 -0.1042 -1.4634 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 1 0 0 0 0 1 4 1 0 0 0 0 2 11 1 0 0 0 0 2 17 1 0 0 0 0 3 6 2 0 0 0 0 4 8 2 0 0 0 0 5 7 2 0 0 0 0 5 9 1 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 12 1 0 0 0 0 8 10 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 14 1 0 0 0 0 11 15 1 0 0 0 0 11 16 1 0 0 0 0 M END $$$$