BM1R2K -OEChem-04012115392D 31 33 0 0 0 0 0 0 0999 V2000 4.5921 -0.5247 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3405 -0.4901 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2066 1.0099 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3405 2.5099 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4745 1.0099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4745 2.0099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5806 0.4753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3405 0.5099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5806 2.5446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2066 2.0099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6745 0.9891 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6745 2.0307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7319 -1.0347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0726 2.5099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8602 -0.5447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7435 -2.0346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.0547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8833 -2.5446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0116 -2.0546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5877 3.1645 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1388 0.6770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7435 0.6999 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1388 2.3428 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3826 1.9730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6095 2.8199 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7626 3.0468 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8530 0.0752 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2840 -2.3384 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4595 -0.7509 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8905 -3.1645 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4782 -2.3708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 7 1 0 0 0 0 1 13 1 0 0 0 0 2 8 2 0 0 0 0 3 8 1 0 0 0 0 3 10 1 0 0 0 0 3 22 1 0 0 0 0 4 6 1 0 0 0 0 4 10 2 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 5 8 1 0 0 0 0 6 9 1 0 0 0 0 7 11 2 0 0 0 0 9 12 2 0 0 0 0 9 20 1 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 21 1 0 0 0 0 12 23 1 0 0 0 0 13 15 2 0 0 0 0 13 16 1 0 0 0 0 14 24 1 0 0 0 0 14 25 1 0 0 0 0 14 26 1 0 0 0 0 15 17 1 0 0 0 0 15 27 1 0 0 0 0 16 18 2 0 0 0 0 16 28 1 0 0 0 0 17 19 2 0 0 0 0 17 29 1 0 0 0 0 18 19 1 0 0 0 0 18 30 1 0 0 0 0 19 31 1 0 0 0 0 M END $$$$