85X CCTOOLS-0919241031 47 52 0 0 0 0 0 0 0 0999 V2000 -3.3240 3.1040 0.2920 O 0 0 0 0 0 -2.1080 3.1040 0.2510 C 0 0 0 0 0 -1.3380 4.2010 0.3440 N 0 0 0 0 0 0.0690 3.7920 0.2540 C 0 0 0 0 0 0.0610 2.2920 0.0920 C 0 0 0 0 0 -1.2740 1.9020 0.1010 C 0 0 0 0 0 -1.5970 0.5330 -0.0350 C 0 0 0 0 0 -2.8730 -0.2000 -0.0660 C 0 0 0 0 0 -4.2080 0.1920 0.0270 C 0 0 0 0 0 -5.2060 -0.7560 -0.0380 C 0 0 0 0 0 -4.8870 -2.0970 -0.1940 C 0 0 0 0 0 -3.5720 -2.4990 -0.2870 C 0 0 0 0 0 -2.5490 -1.5570 -0.2250 C 0 0 0 0 0 -1.1740 -1.6690 -0.2890 N 0 0 0 0 0 -0.4420 -2.9280 -0.4530 C 0 0 0 0 0 -0.5870 -0.4200 -0.1760 C 0 0 0 0 0 0.7550 -0.0140 -0.1830 C 0 0 0 0 0 1.0700 1.3460 -0.0430 C 0 0 0 0 0 2.5420 1.4380 -0.0900 C 0 0 0 0 0 3.4380 2.5010 -0.0070 C 0 0 0 0 0 4.7940 2.2610 -0.0870 C 0 0 0 0 0 5.2650 0.9670 -0.2500 C 0 0 0 0 0 4.3890 -0.0930 -0.3350 C 0 0 0 0 0 3.0170 0.1290 -0.2550 C 0 0 0 0 0 1.9310 -0.7260 -0.3040 N 0 0 0 0 0 2.0170 -2.1790 -0.4630 C 0 0 0 0 0 2.0780 -2.8410 0.9150 C 0 0 0 0 0 2.0230 -4.3030 0.7610 C 0 0 0 0 0 1.9820 -5.4320 0.6410 N 0 0 0 0 0 0.5360 4.2600 -0.6130 H 0 0 0 0 0 -4.4600 1.2350 0.1500 H 0 0 0 0 0 -6.2400 -0.4540 0.0340 H 0 0 0 0 0 -5.6760 -2.8330 -0.2430 H 0 0 0 0 0 -3.3350 -3.5460 -0.4080 H 0 0 0 0 0 -0.1110 -3.0230 -1.4870 H 0 0 0 0 0 0.4240 -2.9330 0.2090 H 0 0 0 0 0 -1.0960 -3.7630 -0.2030 H 0 0 0 0 0 3.0730 3.5090 0.1200 H 0 0 0 0 0 5.4900 3.0830 -0.0220 H 0 0 0 0 0 6.3280 0.7890 -0.3130 H 0 0 0 0 0 4.7660 -1.0970 -0.4620 H 0 0 0 0 0 1.1380 -2.5390 -1.0000 H 0 0 0 0 0 2.9150 -2.4310 -1.0270 H 0 0 0 0 0 3.0070 -2.5620 1.4110 H 0 0 0 0 0 1.2310 -2.5070 1.5160 H 0 0 0 0 0 -1.6570 5.1100 0.4520 H 0 0 0 0 0 0.6030 4.0690 1.1630 H 0 0 0 0 0 2 1 2 0 0 0 3 2 1 0 0 0 3 46 1 0 0 0 4 5 1 0 0 0 4 3 1 0 0 0 4 30 1 0 0 0 4 47 1 0 0 0 5 6 2 0 0 0 6 2 1 0 0 0 6 7 1 0 0 0 7 8 1 0 0 0 8 13 2 0 0 0 8 9 1 0 0 0 9 10 2 0 0 0 9 31 1 0 0 0 10 11 1 0 0 0 10 32 1 0 0 0 11 33 1 0 0 0 12 11 2 0 0 0 12 34 1 0 0 0 13 12 1 0 0 0 14 13 1 0 0 0 15 14 1 0 0 0 15 35 1 0 0 0 15 36 1 0 0 0 15 37 1 0 0 0 16 7 2 0 0 0 16 14 1 0 0 0 17 16 1 0 0 0 18 17 2 0 0 0 18 5 1 0 0 0 19 18 1 0 0 0 20 19 2 0 0 0 20 38 1 0 0 0 21 20 1 0 0 0 21 39 1 0 0 0 22 21 2 0 0 0 22 23 1 0 0 0 22 40 1 0 0 0 23 24 2 0 0 0 23 41 1 0 0 0 24 19 1 0 0 0 24 25 1 0 0 0 25 26 1 0 0 0 25 17 1 0 0 0 26 42 1 0 0 0 26 43 1 0 0 0 27 26 1 0 0 0 27 44 1 0 0 0 27 45 1 0 0 0 28 27 1 0 0 0 29 28 3 0 0 0 M END $$$$