IFLAB-ZINC04359871 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 1 0 0 0 0 0999 V2000 -0.0660 1.3270 0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0320 -0.0550 0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1820 -0.7160 0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3610 0.0050 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3270 1.3870 0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1130 2.0480 0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6840 -0.7160 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2210 -0.7270 -1.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0760 -1.8550 -2.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5680 -1.8660 -3.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2050 -0.7480 -4.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3500 0.3800 -3.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8530 0.3920 -1.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6330 -0.0280 0.8580 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6550 -0.3070 2.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8870 -1.1300 2.6360 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5280 0.3260 2.9840 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5520 0.0220 4.4180 C 0 0 3 0 0 0 0 0 0 0 0 0 4.5500 -0.2010 4.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5240 -1.1410 4.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1540 -0.7620 6.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7600 -1.5240 6.7670 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9460 0.5410 6.2980 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1870 1.1820 5.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3940 1.2020 7.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2350 2.5760 7.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6790 3.2260 8.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2820 2.5090 9.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4420 1.1400 9.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9950 0.4840 8.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0150 1.8430 0.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9540 -0.6180 0.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2080 -1.7960 0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2480 1.9500 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0860 3.1270 0.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5470 -1.7410 0.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5780 -2.7290 -1.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4560 -2.7470 -4.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5910 -0.7570 -5.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8480 1.2530 -3.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9630 1.2750 -1.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2460 0.6280 0.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1410 0.9820 2.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9790 -2.0800 4.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2850 -1.2150 3.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8540 1.7600 4.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4100 1.8240 5.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7640 3.1360 6.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5550 4.2940 8.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6280 3.0190 10.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9140 0.5840 10.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1170 -0.5860 8.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 14 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 11 12 2 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 42 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 24 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 48 1 0 0 0 0 27 28 1 0 0 0 0 27 49 1 0 0 0 0 28 29 2 0 0 0 0 28 50 1 0 0 0 0 29 30 1 0 0 0 0 29 51 1 0 0 0 0 30 52 1 0 0 0 0 M END