BKTJ82 -OEChem-04012118082D 46 48 0 1 0 0 0 0 0999 V2000 3.3660 -5.9796 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -5.6136 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.3660 -4.2475 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 5.9954 3.3523 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2320 0.9253 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -4.6136 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5942 4.3704 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4186 2.7524 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5411 -0.0258 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9230 -0.0258 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0942 5.2364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6160 4.5783 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4250 5.9796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5115 5.5728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4131 2.6478 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.0009 3.4569 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8198 1.7343 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.8144 1.6298 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2320 0.9253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.6136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.6136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.1136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.1136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -3.1136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.1136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.6136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -5.1136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5957 4.8720 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5090 5.6972 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9960 4.5783 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5512 3.9617 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9266 6.3440 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1150 6.5165 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3199 6.1625 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9050 5.4439 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0487 2.1463 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1843 2.2359 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7496 1.0132 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4310 1.5650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8792 2.2464 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1664 3.3188 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0542 2.2508 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -1.8036 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -1.8036 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -3.4236 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -3.4236 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 27 1 0 0 0 0 2 27 1 0 0 0 0 3 27 1 0 0 0 0 4 16 2 0 0 0 0 5 10 1 0 0 0 0 5 19 1 0 0 0 0 6 26 1 0 0 0 0 6 27 1 0 0 0 0 7 11 1 0 0 0 0 7 12 1 0 0 0 0 7 16 1 0 0 0 0 15 8 1 6 0 0 0 8 41 1 0 0 0 0 8 42 1 0 0 0 0 9 19 2 0 0 0 0 9 20 1 0 0 0 0 10 20 2 0 0 0 0 11 13 1 0 0 0 0 11 28 1 0 0 0 0 11 29 1 0 0 0 0 12 14 1 0 0 0 0 12 30 1 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 13 33 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 36 1 0 0 0 0 17 18 1 6 0 0 0 17 19 1 0 0 0 0 17 37 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 22 24 1 0 0 0 0 22 43 1 0 0 0 0 23 25 2 0 0 0 0 23 44 1 0 0 0 0 24 26 2 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 M END $$$$