BXJ2B7 -OEChem-04042102183D 39 41 0 0 0 0 0 0 0999 V2000 1.2791 1.9706 0.4620 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5212 -0.2935 -0.0686 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3480 0.5122 0.2060 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2309 -1.3412 1.2260 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4984 -1.0794 -0.0423 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4994 -2.1920 -0.1461 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9406 0.2402 0.1595 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7529 -1.6895 -0.8302 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3016 -0.4442 -0.1664 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1266 -1.3707 -0.0612 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8115 -0.3553 0.1021 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9806 1.2497 0.3359 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3844 0.9531 0.3011 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8007 1.8228 0.6634 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2226 -0.6805 0.0536 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9233 -0.6543 -1.1471 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2309 3.0296 -0.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9162 -1.0272 1.2019 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2772 -0.9713 -1.1626 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6148 3.6259 -0.6358 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8789 -1.3049 0.0401 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0898 -3.0328 -0.7175 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7301 -2.5503 0.8645 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5538 -1.4438 -1.8807 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5215 -2.4701 -0.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1985 -2.4000 -0.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2816 2.2801 0.5035 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5001 2.5832 -0.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3722 2.0385 1.6472 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8900 1.8577 0.7547 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4293 -0.3879 -2.0782 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8921 2.6646 -1.4687 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5325 3.7961 -0.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4277 -1.0662 2.1714 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8435 -0.9570 -2.0867 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9783 3.9960 0.3285 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3278 2.8667 -0.9741 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6120 4.4517 -1.3526 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9327 -1.5599 0.0818 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 1 0 0 0 0 1 17 1 0 0 0 0 2 9 2 0 0 0 0 3 7 1 0 0 0 0 3 9 1 0 0 0 0 3 14 1 0 0 0 0 4 18 1 0 0 0 0 4 21 2 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 10 2 0 0 0 0 6 8 1 0 0 0 0 6 22 1 0 0 0 0 6 23 1 0 0 0 0 7 12 2 0 0 0 0 8 9 1 0 0 0 0 8 24 1 0 0 0 0 8 25 1 0 0 0 0 10 11 1 0 0 0 0 10 26 1 0 0 0 0 11 13 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 27 1 0 0 0 0 14 28 1 0 0 0 0 14 29 1 0 0 0 0 14 30 1 0 0 0 0 15 16 1 0 0 0 0 15 18 2 0 0 0 0 16 19 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 17 33 1 0 0 0 0 18 34 1 0 0 0 0 19 21 1 0 0 0 0 19 35 1 0 0 0 0 20 36 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 21 39 1 0 0 0 0 M END $$$$