B87IKZ -OEChem-04022117263D 33 35 0 1 0 0 0 0 0999 V2000 -0.9917 -3.2733 0.5032 S 0 0 0 0 0 0 0 0 0 0 0 0 0.3827 -0.2064 -1.3427 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8584 -1.3282 -0.1409 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0793 0.7882 -0.4144 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5512 -0.1686 0.6993 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8097 -0.4637 0.6896 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.8126 0.6153 0.4168 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9925 0.0727 -0.0743 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5979 -1.7310 0.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4323 -0.2640 -0.1182 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7164 1.9827 0.5884 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9607 -2.1499 -0.6071 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8190 2.7619 0.2486 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9591 2.1267 -0.2421 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8955 0.0216 0.3005 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8855 0.0915 1.2667 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1933 0.1331 -1.0477 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2108 0.2786 0.8737 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5186 0.3200 -1.4406 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5273 0.3927 -0.4797 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6112 -0.4945 1.7681 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8123 2.4409 0.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8093 -2.0252 0.0723 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6843 -3.2057 -0.6364 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2443 -1.8315 -1.6148 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4148 -0.2400 1.7051 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7924 3.8401 0.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8357 2.7049 -0.5167 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6501 0.0037 2.3236 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4700 0.0875 -1.8484 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9962 0.3353 1.6217 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7666 0.4091 -2.4943 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5592 0.5383 -0.7857 H 0 0 0 0 0 0 0 0 0 0 0 0 1 9 2 0 0 0 0 2 10 2 0 0 0 0 3 8 1 0 0 0 0 3 9 1 0 0 0 0 3 12 1 0 0 0 0 4 8 1 0 0 0 0 4 14 2 0 0 0 0 5 10 1 0 0 0 0 5 15 1 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 6 9 1 0 0 0 0 6 10 1 0 0 0 0 6 21 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 11 13 2 0 0 0 0 11 22 1 0 0 0 0 12 23 1 0 0 0 0 12 24 1 0 0 0 0 12 25 1 0 0 0 0 13 14 1 0 0 0 0 13 27 1 0 0 0 0 14 28 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 16 18 1 0 0 0 0 16 29 1 0 0 0 0 17 19 2 0 0 0 0 17 30 1 0 0 0 0 18 20 2 0 0 0 0 18 31 1 0 0 0 0 19 20 1 0 0 0 0 19 32 1 0 0 0 0 20 33 1 0 0 0 0 M END $$$$