B2RVT1 -OEChem-04012120132D 48 50 0 0 0 0 0 0 0999 V2000 2.8660 0.0209 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2566 3.7460 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1674 2.6627 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6808 1.2233 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5116 -0.3858 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 0.3573 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.4791 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5875 3.0029 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1702 3.3393 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.8088 1.6757 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.9791 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6321 4.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4242 3.3318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9595 1.6846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7026 1.0154 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8890 4.9791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5832 4.6190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.0209 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.4791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0875 2.1369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.9791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0656 2.3448 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.9791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.4791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.4791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -4.4791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -4.4791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0929 3.8951 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8494 3.5641 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0957 2.8060 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3846 1.9168 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6309 1.1588 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7570 2.8543 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3038 5.4398 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4282 5.3940 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4741 4.5184 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7748 4.0293 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1729 4.8106 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3916 5.2086 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -1.7891 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6540 -1.3965 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2554 -2.0868 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -3.1691 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -3.1691 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3984 1.8672 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6799 1.0692 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -4.7891 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -4.7891 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 19 2 0 0 0 0 2 8 1 0 0 0 0 2 9 1 0 0 0 0 3 13 1 0 0 0 0 3 14 1 0 0 0 0 3 33 1 0 0 0 0 4 6 1 0 0 0 0 4 15 1 0 0 0 0 4 20 1 0 0 0 0 5 6 2 0 0 0 0 5 18 1 0 0 0 0 7 19 1 0 0 0 0 7 21 1 0 0 0 0 7 40 1 0 0 0 0 8 20 2 0 0 0 0 9 22 2 0 0 0 0 10 22 1 0 0 0 0 10 45 1 0 0 0 0 10 46 1 0 0 0 0 11 26 2 0 0 0 0 11 27 1 0 0 0 0 12 13 1 0 0 0 0 12 16 1 0 0 0 0 12 17 1 0 0 0 0 12 28 1 0 0 0 0 13 29 1 0 0 0 0 13 30 1 0 0 0 0 14 15 1 0 0 0 0 14 31 1 0 0 0 0 14 32 1 0 0 0 0 15 18 2 0 0 0 0 16 34 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 20 22 1 0 0 0 0 21 23 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 24 26 1 0 0 0 0 24 43 1 0 0 0 0 25 27 2 0 0 0 0 25 44 1 0 0 0 0 26 47 1 0 0 0 0 27 48 1 0 0 0 0 M END $$$$