BK01JP -OEChem-04012117372D 43 45 0 0 0 0 0 0 0999 V2000 6.5116 1.7480 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 -4.3453 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5981 0.1547 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0084 3.5093 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 -2.8453 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 -0.8453 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 1.6547 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1674 4.7965 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -4.3453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -4.3453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 -5.2113 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 -3.8453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 -2.3453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -2.3453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 -1.3453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -1.3453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 0.1547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 0.6547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5981 2.1547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7026 3.1492 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6808 3.3571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1808 2.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9595 3.8183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8395 -3.7464 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8923 -3.7347 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4174 -4.5574 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0250 -5.6099 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9750 -5.6099 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9441 -2.9279 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3426 -2.2377 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3894 -2.2377 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7880 -2.9279 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3426 -1.4530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9441 -0.7627 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7880 -0.7627 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3894 -1.4530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6540 0.7373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2554 0.0470 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1951 1.9647 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9329 3.9235 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7974 2.4263 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7066 5.2113 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7570 4.9881 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 19 1 0 0 0 0 1 22 1 0 0 0 0 2 12 2 0 0 0 0 3 18 2 0 0 0 0 4 23 2 0 0 0 0 5 12 1 0 0 0 0 5 13 1 0 0 0 0 5 14 1 0 0 0 0 6 15 1 0 0 0 0 6 16 1 0 0 0 0 6 17 1 0 0 0 0 7 18 1 0 0 0 0 7 19 1 0 0 0 0 7 39 1 0 0 0 0 8 23 1 0 0 0 0 8 42 1 0 0 0 0 8 43 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 12 1 0 0 0 0 9 24 1 0 0 0 0 10 11 1 0 0 0 0 10 25 1 0 0 0 0 10 26 1 0 0 0 0 11 27 1 0 0 0 0 11 28 1 0 0 0 0 13 15 1 0 0 0 0 13 29 1 0 0 0 0 13 30 1 0 0 0 0 14 16 1 0 0 0 0 14 31 1 0 0 0 0 14 32 1 0 0 0 0 15 33 1 0 0 0 0 15 34 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 20 23 1 0 0 0 0 21 22 2 0 0 0 0 21 40 1 0 0 0 0 22 41 1 0 0 0 0 M END $$$$