B60XCS -OEChem-04012116212D 45 46 0 1 0 0 0 0 0999 V2000 4.7320 3.7990 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.0670 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -3.4330 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 6.6962 -3.7990 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 7.6962 -2.0670 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.9330 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.9330 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 2.0670 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2320 2.9330 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.0670 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.2320 2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -2.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 3.7990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8301 -3.2990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8301 -1.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2320 2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7571 3.3315 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7571 2.5345 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5560 2.1039 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 1.2570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1760 1.0300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8397 4.4096 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1494 4.0111 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0747 -1.0407 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6762 -0.3504 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 0.8770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9272 -2.2430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2932 -2.9890 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5201 -3.8360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3671 -3.6090 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3671 -1.8770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1401 -1.0300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2932 -1.2570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -0.7430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5420 3.4700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5420 2.3961 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 15 1 0 0 0 0 1 24 1 0 0 0 0 2 19 1 0 0 0 0 3 20 1 0 0 0 0 4 20 1 0 0 0 0 5 20 1 0 0 0 0 6 23 1 0 0 0 0 7 13 1 0 0 0 0 7 17 1 0 0 0 0 7 36 1 0 0 0 0 8 10 1 0 0 0 0 8 24 2 0 0 0 0 9 24 1 0 0 0 0 9 44 1 0 0 0 0 9 45 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 14 1 1 0 0 0 11 15 1 0 0 0 0 11 26 1 0 0 0 0 11 27 1 0 0 0 0 12 18 1 0 0 0 0 12 19 2 0 0 0 0 13 20 1 0 0 0 0 13 21 1 0 0 0 0 13 22 1 0 0 0 0 14 28 1 0 0 0 0 14 29 1 0 0 0 0 14 30 1 0 0 0 0 15 31 1 0 0 0 0 15 32 1 0 0 0 0 16 17 1 0 0 0 0 16 18 2 0 0 0 0 16 23 1 0 0 0 0 17 33 1 0 0 0 0 17 34 1 0 0 0 0 18 35 1 0 0 0 0 19 25 1 0 0 0 0 21 37 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 22 40 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 23 25 2 0 0 0 0 25 43 1 0 0 0 0 M END $$$$