B6CAZ2 -OEChem-04022109393D 41 42 0 1 0 0 0 0 0999 V2000 0.3097 2.7769 -0.8107 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6698 -2.9708 1.2553 O 0 5 0 0 0 0 0 0 0 0 0 0 -4.6503 2.4691 -0.7268 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.8478 -3.2007 1.1054 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5841 0.5385 -0.2575 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3980 1.4652 0.7630 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9609 2.1896 1.5014 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8080 -2.5054 1.0064 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.5700 1.2691 -0.3690 N 0 3 0 0 0 0 0 0 0 0 0 0 3.8494 1.3180 1.0969 C 0 0 2 0 0 0 0 0 0 0 0 0 4.3366 0.4698 -0.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6334 2.1985 0.7736 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3424 -0.5481 -0.6012 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3204 1.8199 -0.0409 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3331 -1.8375 -0.0692 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4331 -0.1992 -1.5997 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8952 0.9751 0.0838 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4143 -2.7780 -0.5356 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5143 -1.1393 -2.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1504 1.5139 -0.1983 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7816 -0.3566 0.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9231 -1.1495 0.6002 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2921 0.7209 -0.0813 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5050 -2.4288 -1.5339 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1784 -0.6107 0.3181 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6102 0.6560 1.9389 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2594 -0.0605 0.1782 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6234 1.1254 -0.9316 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5046 2.9659 1.5472 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7679 2.7264 -0.1779 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2872 0.7464 1.4704 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7617 1.6198 1.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6957 2.7199 2.3306 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0343 -2.1205 0.7112 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4376 0.7972 -2.0333 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2225 2.5553 -0.5034 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1925 -0.7838 0.6964 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4054 -3.7812 -0.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8069 -0.8678 -2.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7883 -3.1602 -1.8957 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0685 -1.2289 0.4093 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 2 0 0 0 0 2 8 1 0 0 0 0 3 9 1 0 0 0 0 4 8 2 0 0 0 0 5 9 2 0 0 0 0 6 12 1 0 0 0 0 6 14 1 0 0 0 0 6 31 1 0 0 0 0 7 10 1 0 0 0 0 7 32 1 0 0 0 0 7 33 1 0 0 0 0 8 22 1 0 0 0 0 9 23 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 26 1 0 0 0 0 11 13 1 0 0 0 0 11 27 1 0 0 0 0 11 28 1 0 0 0 0 12 29 1 0 0 0 0 12 30 1 0 0 0 0 13 15 2 0 0 0 0 13 16 1 0 0 0 0 14 17 1 0 0 0 0 15 18 1 0 0 0 0 15 34 1 0 0 0 0 16 19 2 0 0 0 0 16 35 1 0 0 0 0 17 20 2 0 0 0 0 17 21 1 0 0 0 0 18 24 2 0 0 0 0 18 38 1 0 0 0 0 19 24 1 0 0 0 0 19 39 1 0 0 0 0 20 23 1 0 0 0 0 20 36 1 0 0 0 0 21 22 2 0 0 0 0 21 37 1 0 0 0 0 22 25 1 0 0 0 0 23 25 2 0 0 0 0 24 40 1 0 0 0 0 25 41 1 0 0 0 0 M CHG 4 2 -1 3 -1 8 1 9 1 M END $$$$