Ketcher 10251710322D 1 1.00000 0.00000 0 43 47 0 1 0 999 V2000 12.9002 -7.3983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6977 -7.8882 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.5458 -7.3990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5462 -6.4203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6987 -5.9304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8508 -6.4193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2912 -6.9085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4369 -7.3983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5817 -6.9045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7264 -7.3983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7264 -8.3859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1457 -7.3983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8517 -8.3932 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0029 -6.9083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9944 -8.8832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1468 -8.3875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9890 -9.8651 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5839 -8.8781 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5839 -9.8629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4354 -10.3498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4300 -11.3330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1383 -10.3593 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1328 -11.3423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2820 -11.8257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2751 -12.8041 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1190 -13.2991 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9698 -12.8160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9767 -11.8374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5817 -5.9171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8714 -6.9045 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8719 -8.8805 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5732 -11.8240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3188 -10.8351 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1121 -14.2867 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.8216 -13.3158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2837 -9.8642 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.4017 -5.9269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4008 -7.8932 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4002 -8.8808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2562 -7.4000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5581 -12.8100 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.6992 -4.9429 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2609 -13.7897 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8 9 2 0 0 0 9 10 1 0 0 0 20 21 2 0 0 0 21 24 1 0 0 0 23 22 1 6 0 0 10 11 1 0 0 0 11 18 1 0 0 0 5 6 1 0 0 0 1 6 1 1 0 0 12 16 1 0 0 0 23 24 1 0 0 0 24 25 1 0 0 0 25 26 1 0 0 0 26 27 1 0 0 0 27 28 2 0 0 0 28 23 1 0 0 0 15 13 1 0 0 0 9 29 1 0 0 0 13 1 1 0 0 0 10 30 1 6 0 0 1 14 1 0 0 0 11 31 1 6 0 0 14 12 1 0 0 0 21 32 1 0 0 0 12 7 1 1 0 0 24 33 1 6 0 0 7 8 1 0 0 0 26 34 2 0 0 0 1 2 1 6 0 0 27 35 1 0 0 0 15 16 1 0 0 0 22 36 2 0 0 0 22 17 1 0 0 0 4 37 1 6 0 0 15 17 1 1 0 0 3 38 1 1 0 0 2 3 1 0 0 0 38 39 1 0 0 0 3 4 1 0 0 0 38 40 1 0 0 0 18 19 2 0 0 0 32 41 1 0 0 0 25 41 1 0 0 0 19 20 1 0 0 0 5 42 1 6 0 0 4 5 1 0 0 0 25 43 1 6 0 0 M END