B4K5MP -OEChem-04012117122D 41 43 0 1 0 0 0 0 0999 V2000 4.5411 -0.2003 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8198 -1.9604 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6443 -1.9604 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.3874 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 4.3874 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.3874 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.8874 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.3875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.9230 -0.2003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2320 -1.1514 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2320 -1.1514 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8660 1.8874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.8874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8144 -1.8559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.8874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 3.3874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4021 -2.6649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 3.3874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9954 -3.5784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3967 -2.5604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5832 -4.3874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9844 -3.3694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5777 -4.2829 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2845 0.6689 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6130 0.3366 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3566 -0.4525 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5135 -1.7038 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9506 -1.7038 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 1.5774 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0277 -1.8956 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3716 -1.5841 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6435 -1.2599 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 3.1974 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 3.9244 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 3.6974 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 2.8505 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3788 -3.6432 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6488 -1.9940 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3310 -4.9538 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6011 -3.3046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9421 -4.7845 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 8 1 0 0 0 0 1 11 1 0 0 0 0 11 2 1 1 0 0 0 2 14 1 0 0 0 0 10 3 1 6 0 0 0 3 30 1 0 0 0 0 4 13 2 0 0 0 0 5 16 2 0 0 0 0 8 6 1 6 0 0 0 6 12 1 0 0 0 0 6 13 1 0 0 0 0 7 13 1 0 0 0 0 7 16 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 24 1 0 0 0 0 9 10 1 0 0 0 0 9 25 1 0 0 0 0 9 26 1 0 0 0 0 10 11 1 0 0 0 0 10 27 1 0 0 0 0 11 28 1 0 0 0 0 12 15 2 0 0 0 0 12 29 1 0 0 0 0 14 17 1 0 0 0 0 14 31 1 0 0 0 0 14 32 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 17 19 2 0 0 0 0 17 20 1 0 0 0 0 18 34 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 19 21 1 0 0 0 0 19 37 1 0 0 0 0 20 22 2 0 0 0 0 20 38 1 0 0 0 0 21 23 2 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 41 1 0 0 0 0 M END $$$$