1245644 Ketcher 12212314322D 1 1.00000 0.00000 0 44 47 0 0 0 999 V2000 11.4561 8.6807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4504 10.7513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5739 10.2758 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5630 9.1938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3564 10.2390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3527 9.2034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1456 9.1969 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1490 10.2328 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2545 10.7570 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4532 9.6963 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3965 11.3418 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2580 11.7680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1354 12.2701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2558 12.7797 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0090 11.7618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8864 12.2641 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3516 8.1971 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6720 8.6807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6720 7.6508 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5630 7.1377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4561 7.6508 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7867 9.1919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9016 8.6807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9016 7.6587 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7867 7.1476 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6720 9.7030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0162 7.1476 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.3413 7.1397 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.8864 13.2863 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.7715 11.7529 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.6720 6.6286 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0919 11.1725 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5082 12.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5630 8.1284 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.6741 12.2739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.5767 11.7529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.5767 10.7107 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.4791 12.2739 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5630 6.0955 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.6819 12.8887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1005 13.3073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1005 13.9329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.6218 14.4020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.6218 15.0797 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1 4 1 0 0 0 1 6 1 0 0 0 5 2 1 0 0 0 2 3 1 0 0 0 3 4 1 0 0 0 5 6 1 0 0 0 7 8 1 0 0 0 8 9 1 0 0 0 9 5 1 0 0 0 6 7 1 0 0 0 1 10 1 1 0 0 5 11 1 1 0 0 9 12 1 0 0 0 12 13 1 0 0 0 12 14 1 1 0 0 13 15 1 0 0 0 15 16 1 0 0 0 6 17 1 6 0 0 4 18 1 0 0 0 18 19 1 0 0 0 19 20 1 0 0 0 20 21 1 0 0 0 21 1 1 0 0 0 18 22 1 0 0 0 22 23 1 0 0 0 23 24 1 0 0 0 24 25 1 0 0 0 25 19 1 0 0 0 18 26 1 1 0 0 24 27 1 6 0 0 21 28 1 1 0 0 16 29 2 0 0 0 16 30 1 0 0 0 19 31 1 1 0 0 9 32 1 6 0 0 12 33 1 6 0 0 4 34 1 6 0 0 30 35 1 0 0 0 35 36 1 1 0 0 36 37 2 0 0 0 36 38 1 0 0 0 20 39 1 1 0 0 35 40 1 0 0 0 40 41 1 0 0 0 41 42 1 0 0 0 42 43 1 0 0 0 43 44 1 0 0 0 M END