DQI CCTOOLS-0919241027 58 60 0 0 0 0 0 0 0 0999 V2000 5.3380 0.4210 0.8470 C 0 0 0 0 0 5.2440 -1.0560 0.4580 C 0 0 0 0 0 5.5210 -1.9120 1.6670 C 0 0 0 0 0 5.0610 1.2780 -0.3620 C 0 0 0 0 0 6.1090 1.7530 -1.1260 C 0 0 0 0 0 5.8560 2.5390 -2.2350 C 0 0 0 0 0 -3.0690 2.9590 2.1820 N 0 0 0 0 0 3.7540 1.5840 -0.7110 C 0 0 0 0 0 1.4020 1.4670 -0.3830 C 0 0 0 0 0 5.4940 -3.2500 1.5620 O 0 0 0 0 0 3.5030 2.3720 -1.8250 C 0 0 0 0 0 4.5540 2.8500 -2.5830 C 0 0 0 0 0 0.3800 0.8500 0.5730 C 0 0 0 0 0 5.7670 -1.3940 2.7300 O 0 0 0 0 0 2.7210 1.1120 0.0360 O 0 0 0 0 0 -1.0330 1.2300 0.1240 C 0 0 0 0 0 -3.2940 0.9750 0.8160 C 0 0 0 0 0 -3.8470 2.1240 1.3920 C 0 0 0 0 0 -5.8780 1.6130 0.4200 C 0 0 0 0 0 -4.1160 0.1710 0.0260 C 0 0 0 0 0 -3.5800 -1.0550 -0.6120 C 0 0 0 0 0 -2.7380 -1.9040 0.1030 C 0 0 0 0 0 -2.2410 -3.0480 -0.4980 C 0 0 0 0 0 -0.9430 -5.0410 -0.4870 C 0 0 0 0 0 -2.5820 -3.3470 -1.8110 C 0 0 0 0 0 -3.4170 -2.5050 -2.5210 C 0 0 0 0 0 -3.9210 -1.3650 -1.9270 C 0 0 0 0 0 -5.1270 2.4050 1.1720 N 0 0 0 0 0 -7.2090 1.9430 0.2160 N 0 0 0 0 0 -5.3920 0.5210 -0.1460 N 0 0 0 0 0 -1.9880 0.6530 1.0170 O 0 0 0 0 0 -1.4190 -3.8790 0.1960 O 0 0 0 0 0 4.6030 0.6400 1.6230 H 0 0 0 0 0 6.3380 0.6360 1.2230 H 0 0 0 0 0 4.2440 -1.2700 0.0820 H 0 0 0 0 0 5.9780 -1.2740 -0.3180 H 0 0 0 0 0 7.1260 1.5120 -0.8570 H 0 0 0 0 0 6.6760 2.9110 -2.8310 H 0 0 0 0 0 -2.1350 2.7480 2.3380 H 0 0 0 0 0 -3.4590 3.7540 2.5780 H 0 0 0 0 0 1.2280 1.0940 -1.3920 H 0 0 0 0 0 1.2980 2.5530 -0.3750 H 0 0 0 0 0 5.6770 -3.7570 2.3650 H 0 0 0 0 0 2.4860 2.6120 -2.0990 H 0 0 0 0 0 4.3590 3.4640 -3.4500 H 0 0 0 0 0 0.4840 -0.2350 0.5640 H 0 0 0 0 0 0.5540 1.2240 1.5820 H 0 0 0 0 0 -1.1370 2.3150 0.1330 H 0 0 0 0 0 -1.2070 0.8560 -0.8850 H 0 0 0 0 0 -2.4730 -1.6710 1.1240 H 0 0 0 0 0 -0.2990 -5.6150 0.1780 H 0 0 0 0 0 -1.7900 -5.6550 -0.7930 H 0 0 0 0 0 -0.3780 -4.7380 -1.3680 H 0 0 0 0 0 -2.1930 -4.2400 -2.2780 H 0 0 0 0 0 -3.6780 -2.7410 -3.5420 H 0 0 0 0 0 -4.5770 -0.7120 -2.4840 H 0 0 0 0 0 -7.7700 1.3750 -0.3360 H 0 0 0 0 0 -7.5790 2.7400 0.6250 H 0 0 0 0 0 1 2 1 0 0 0 1 4 1 0 0 0 1 33 1 0 0 0 1 34 1 0 0 0 2 35 1 0 0 0 2 36 1 0 0 0 3 10 1 0 0 0 3 2 1 0 0 0 4 5 1 0 0 0 5 6 2 0 0 0 5 37 1 0 0 0 6 38 1 0 0 0 7 18 1 0 0 0 7 39 1 0 0 0 7 40 1 0 0 0 8 4 2 0 0 0 8 11 1 0 0 0 9 15 1 0 0 0 9 41 1 0 0 0 9 42 1 0 0 0 10 43 1 0 0 0 11 12 2 0 0 0 11 44 1 0 0 0 12 6 1 0 0 0 12 45 1 0 0 0 13 9 1 0 0 0 13 46 1 0 0 0 13 47 1 0 0 0 14 3 2 0 0 0 15 8 1 0 0 0 16 31 1 0 0 0 16 13 1 0 0 0 16 48 1 0 0 0 16 49 1 0 0 0 17 31 1 0 0 0 17 20 2 0 0 0 18 17 1 0 0 0 19 30 2 0 0 0 20 21 1 0 0 0 21 27 2 0 0 0 21 22 1 0 0 0 22 23 2 0 0 0 22 50 1 0 0 0 23 25 1 0 0 0 23 32 1 0 0 0 24 51 1 0 0 0 24 52 1 0 0 0 24 53 1 0 0 0 25 54 1 0 0 0 26 25 2 0 0 0 26 55 1 0 0 0 27 26 1 0 0 0 27 56 1 0 0 0 28 18 2 0 0 0 28 19 1 0 0 0 29 19 1 0 0 0 29 57 1 0 0 0 29 58 1 0 0 0 30 20 1 0 0 0 32 24 1 0 0 0 M END $$$$