D0K0ZK -OEChem-10191522582D 44 47 0 1 0 0 0 0 0999 V2000 12.7569 -3.1012 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.8171 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 7.4562 2.8933 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4268 -1.6012 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2928 -0.1012 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6472 1.4921 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4781 3.1012 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.4268 1.3988 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.2928 1.8988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4268 0.3988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1588 1.3988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1588 0.3988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5608 1.8988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2928 -1.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1588 -1.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9781 2.2352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1588 -2.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0249 -1.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9836 2.1307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0249 -3.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8909 -1.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3958 2.9397 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5768 1.2171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8909 -2.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4013 2.8352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5823 1.1126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9945 1.9216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6907 0.9738 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6913 2.3737 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8943 2.3737 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8162 0.5064 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2147 -0.1838 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7694 1.2911 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3709 1.9814 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3709 -0.1838 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7694 0.5064 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6219 -2.9112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0249 -0.4812 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0249 -3.7212 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4278 -1.2912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6480 3.5061 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9413 0.7155 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0368 3.3367 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3301 0.5462 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 24 1 0 0 0 0 2 27 1 0 0 0 0 3 7 1 0 0 0 0 3 13 1 0 0 0 0 4 14 2 0 0 0 0 5 10 1 0 0 0 0 5 12 1 0 0 0 0 5 14 1 0 0 0 0 6 13 2 0 0 0 0 6 16 1 0 0 0 0 7 16 2 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 13 1 0 0 0 0 8 28 1 6 0 0 0 9 11 1 0 0 0 0 9 29 1 0 0 0 0 9 30 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 14 15 1 0 0 0 0 15 17 2 0 0 0 0 15 18 1 0 0 0 0 16 19 1 0 0 0 0 17 20 1 0 0 0 0 17 37 1 0 0 0 0 18 21 2 0 0 0 0 18 38 1 0 0 0 0 19 22 2 0 0 0 0 19 23 1 0 0 0 0 20 24 2 0 0 0 0 20 39 1 0 0 0 0 21 24 1 0 0 0 0 21 40 1 0 0 0 0 22 25 1 0 0 0 0 22 41 1 0 0 0 0 23 26 2 0 0 0 0 23 42 1 0 0 0 0 25 27 2 0 0 0 0 25 43 1 0 0 0 0 26 27 1 0 0 0 0 26 44 1 0 0 0 0 M END $$$$