IFLAB-ZINC02700453 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 36 0 0 0 0 0 0 0 0999 V2000 -1.7880 1.2440 1.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4660 -0.1940 1.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4740 -1.1430 2.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1800 -2.4620 2.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8780 -2.8310 0.8910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8710 -1.8810 -0.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1700 -0.5640 0.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5010 -4.5110 0.5180 S 0 0 0 0 0 0 0 0 0 0 0 0 0.2730 -4.4940 -0.6730 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0490 -5.0990 1.7300 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9280 -5.2600 0.1380 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9520 -6.5330 -0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6630 -7.3120 -0.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3960 -7.7220 -1.5090 N 0 3 0 0 0 0 0 0 0 0 0 0 0.4140 -6.9920 -2.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6900 -7.3470 -3.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1020 -8.4860 -4.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7440 -9.2280 -3.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9680 -8.8140 -1.9770 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1300 -7.1660 -0.2500 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8700 1.7730 2.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2470 1.7150 0.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4780 1.2830 2.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7100 -0.8550 3.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1850 -3.2030 2.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6340 -2.1690 -1.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1680 0.1780 -0.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1550 -6.6870 0.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7470 -8.1970 0.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8680 -6.1060 -1.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3540 -6.7440 -4.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2990 -8.7880 -5.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2190 -10.1210 -3.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6230 -9.3880 -1.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0470 -8.1170 -0.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 24 1 0 0 0 0 4 5 1 0 0 0 0 4 25 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 26 1 0 0 0 0 7 27 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 20 1 0 0 0 0 13 14 1 0 0 0 0 13 28 1 0 0 0 0 13 29 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 30 1 0 0 0 0 16 17 1 0 0 0 0 16 31 1 0 0 0 0 17 18 2 0 0 0 0 17 32 1 0 0 0 0 18 19 1 0 0 0 0 18 33 1 0 0 0 0 19 34 1 0 0 0 0 20 35 1 0 0 0 0 M CHG 1 14 1 M END