B5DAZ9 -OEChem-04012113373D 39 41 0 1 0 0 0 0 0999 V2000 1.7055 -1.7659 -0.7125 S 0 0 0 0 0 0 0 0 0 0 0 0 2.5513 -2.2873 0.3449 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6724 -2.4149 -2.0102 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0399 -0.0632 -0.9227 N 0 0 1 0 0 0 0 0 0 0 0 0 0.8700 1.4949 0.6886 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0521 2.0591 1.9012 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9050 -1.7590 1.2575 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9123 0.6887 0.3106 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0365 -1.7636 -0.1263 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2141 0.2558 -1.8089 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8240 0.7326 1.3371 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2771 1.7512 -0.0399 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9997 -1.8248 -1.0412 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2003 -1.7008 1.2355 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2416 1.5910 2.2886 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3158 -1.8227 -0.5792 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5164 -1.6988 1.6973 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2365 1.7314 -1.4341 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4754 2.0262 0.6191 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5742 -1.7599 0.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3940 1.9868 -2.1693 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6330 2.2814 -0.1162 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5922 2.2617 -1.5103 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3178 1.3408 -1.9099 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0459 -0.1606 -2.8058 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1346 -0.1540 -1.3837 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7742 0.2217 1.3942 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8206 -1.8638 -2.1111 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6080 -1.6542 1.9585 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6345 1.8952 3.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1315 -1.8669 -1.2963 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7049 -1.6488 2.7667 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6753 1.5894 -2.0017 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5426 2.0364 1.7042 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3602 1.9854 -3.2548 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5669 2.4921 0.3966 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4931 2.4622 -2.0827 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6724 -1.7982 0.5999 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0928 -1.7090 2.2499 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 2 0 0 0 0 1 4 1 0 0 0 0 1 9 1 0 0 0 0 4 8 1 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 5 12 1 0 0 0 0 6 15 2 0 0 0 0 7 20 1 0 0 0 0 7 38 1 0 0 0 0 7 39 1 0 0 0 0 8 11 2 0 0 0 0 9 13 2 0 0 0 0 9 14 1 0 0 0 0 10 24 1 0 0 0 0 10 25 1 0 0 0 0 10 26 1 0 0 0 0 11 15 1 0 0 0 0 11 27 1 0 0 0 0 12 18 2 0 0 0 0 12 19 1 0 0 0 0 13 16 1 0 0 0 0 13 28 1 0 0 0 0 14 17 2 0 0 0 0 14 29 1 0 0 0 0 15 30 1 0 0 0 0 16 20 2 0 0 0 0 16 31 1 0 0 0 0 17 20 1 0 0 0 0 17 32 1 0 0 0 0 18 21 1 0 0 0 0 18 33 1 0 0 0 0 19 22 2 0 0 0 0 19 34 1 0 0 0 0 21 23 2 0 0 0 0 21 35 1 0 0 0 0 22 23 1 0 0 0 0 22 36 1 0 0 0 0 23 37 1 0 0 0 0 M END $$$$