PB3 CCTOOLS-0919241031 50 52 0 0 0 0 0 0 0 0999 V2000 -0.5580 -0.0650 -1.1960 C 0 0 0 0 0 -1.2760 -0.0010 0.0000 C 0 0 0 0 0 -0.5590 0.0640 1.1960 C 0 0 0 0 0 0.7700 -0.0620 -1.1500 N 0 0 0 0 0 1.6320 -2.0530 8.2870 C 0 0 0 0 0 1.6310 2.0560 -8.2850 C 0 0 0 0 0 -1.2680 0.1340 2.4980 C 0 0 0 0 0 -1.2650 0.2670 4.9310 C 0 0 0 0 0 -0.2570 0.3290 6.0500 C 0 0 0 0 0 -1.2670 -0.1370 -2.4980 C 0 0 0 0 0 0.2000 0.8370 -6.6310 C 0 0 0 0 0 1.1320 -1.6070 -7.5230 C 0 0 0 0 0 0.2040 1.5520 6.4970 C 0 0 0 0 0 1.1280 1.6090 7.5240 C 0 0 0 0 0 1.5910 0.4420 8.1030 C 0 0 0 0 0 0.2080 -0.8380 6.6260 C 0 0 0 0 0 0.7690 0.0680 1.1500 N 0 0 0 0 0 1.4070 0.0010 0.0000 C 0 0 0 0 0 -0.5650 0.1970 3.6460 N 0 0 0 0 0 -0.5640 -0.1990 -3.6460 N 0 0 0 0 0 -1.2640 -0.2700 -4.9310 C 0 0 0 0 0 -0.2560 -0.3300 -6.0490 C 0 0 0 0 0 1.1280 0.7830 -7.6540 C 0 0 0 0 0 1.5930 -0.4390 -8.1020 C 0 0 0 0 0 0.2070 -1.5520 -6.4970 C 0 0 0 0 0 1.1280 -0.7810 7.6550 C 0 0 0 0 0 -2.4820 -0.1400 -2.5290 O 0 0 0 0 0 -2.4820 0.1350 2.5290 O 0 0 0 0 0 -2.3560 -0.0020 0.0000 H 0 0 0 0 0 0.9900 -2.3220 9.1250 H 0 0 0 0 0 1.6200 -2.8550 7.5480 H 0 0 0 0 0 2.6510 -1.9030 8.6430 H 0 0 0 0 0 0.9890 2.3240 -9.1240 H 0 0 0 0 0 1.6170 2.8570 -7.5460 H 0 0 0 0 0 2.6510 1.9070 -8.6400 H 0 0 0 0 0 -1.8890 -0.6170 5.0530 H 0 0 0 0 0 -1.8900 1.1590 4.9560 H 0 0 0 0 0 -0.1620 1.7930 -6.2820 H 0 0 0 0 0 1.4950 -2.5620 -7.8720 H 0 0 0 0 0 -0.1570 2.4640 6.0460 H 0 0 0 0 0 1.4890 2.5650 7.8740 H 0 0 0 0 0 2.3130 0.4860 8.9050 H 0 0 0 0 0 -0.1520 -1.7940 6.2760 H 0 0 0 0 0 2.4870 0.0020 0.0000 H 0 0 0 0 0 0.4040 0.1970 3.6210 H 0 0 0 0 0 0.4050 -0.1960 -3.6210 H 0 0 0 0 0 -1.8900 0.6130 -5.0530 H 0 0 0 0 0 -1.8880 -1.1630 -4.9560 H 0 0 0 0 0 2.3160 -0.4820 -8.9030 H 0 0 0 0 0 -0.1520 -2.4650 -6.0450 H 0 0 0 0 0 1 2 1 0 0 0 1 4 2 0 0 0 1 10 1 0 0 0 2 3 2 0 0 0 2 29 1 0 0 0 3 7 1 0 0 0 3 17 1 0 0 0 4 18 1 0 0 0 5 26 1 0 0 0 5 30 1 0 0 0 5 31 1 0 0 0 5 32 1 0 0 0 6 23 1 0 0 0 6 33 1 0 0 0 6 34 1 0 0 0 6 35 1 0 0 0 7 19 1 0 0 0 7 28 2 0 0 0 8 9 1 0 0 0 8 19 1 0 0 0 8 36 1 0 0 0 8 37 1 0 0 0 9 13 2 0 0 0 9 16 1 0 0 0 10 20 1 0 0 0 10 27 2 0 0 0 11 22 1 0 0 0 11 23 2 0 0 0 11 38 1 0 0 0 12 24 2 0 0 0 12 25 1 0 0 0 12 39 1 0 0 0 13 14 1 0 0 0 13 40 1 0 0 0 14 15 2 0 0 0 14 41 1 0 0 0 15 26 1 0 0 0 15 42 1 0 0 0 16 26 2 0 0 0 16 43 1 0 0 0 17 18 2 0 0 0 18 44 1 0 0 0 19 45 1 0 0 0 20 21 1 0 0 0 20 46 1 0 0 0 21 22 1 0 0 0 21 47 1 0 0 0 21 48 1 0 0 0 22 25 2 0 0 0 23 24 1 0 0 0 24 49 1 0 0 0 25 50 1 0 0 0 M END $$$$