BU8IZ6 -OEChem-04012112452D 54 54 0 1 0 0 0 0 0999 V2000 6.3301 -1.9881 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -0.4881 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2981 0.3125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3196 3.2981 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.0119 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.8334 1.9598 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.9881 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.4786 2.0109 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1391 1.5997 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.8301 2.5508 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8301 2.5508 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5211 1.5997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.4881 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.3301 0.0119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.4881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.9881 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.0902 1.2907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.4881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.9881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.4881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.9881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7844 1.6508 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.9923 0.6727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5275 2.3199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2361 0.9873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4366 2.6797 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7653 3.1674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8949 3.1674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2237 2.6797 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9547 1.8519 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2111 1.0628 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.1081 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0611 -2.2981 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2520 0.0945 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8535 -0.5957 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1306 -1.0131 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3335 -1.0131 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.3681 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7044 2.5663 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0611 -3.2981 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -3.2981 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -0.9511 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -1.1781 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -2.0250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2460 -2.9881 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.6081 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4860 -2.9881 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6555 2.2572 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -2.6081 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3859 0.5437 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1212 0.0662 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5988 0.8016 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9394 2.4258 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6075 1.4045 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13 1 1 1 0 0 0 1 49 1 0 0 0 0 2 14 2 0 0 0 0 3 17 2 0 0 0 0 4 24 2 0 0 0 0 5 9 1 0 0 0 0 5 12 1 0 0 0 0 5 14 1 0 0 0 0 6 17 1 0 0 0 0 22 6 1 6 0 0 0 6 39 1 0 0 0 0 16 7 1 1 0 0 0 7 40 1 0 0 0 0 7 41 1 0 0 0 0 8 24 1 0 0 0 0 8 53 1 0 0 0 0 8 54 1 0 0 0 0 9 10 1 0 0 0 0 9 17 1 1 0 0 0 9 25 1 0 0 0 0 10 11 1 0 0 0 0 10 26 1 0 0 0 0 10 27 1 0 0 0 0 11 12 1 0 0 0 0 11 28 1 0 0 0 0 11 29 1 0 0 0 0 12 30 1 0 0 0 0 12 31 1 0 0 0 0 13 15 1 0 0 0 0 13 16 1 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 16 18 1 0 0 0 0 16 33 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 38 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 48 1 0 0 0 0 23 50 1 0 0 0 0 23 51 1 0 0 0 0 23 52 1 0 0 0 0 M END $$$$