IBS-ZINC05216207 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 0 0 0 0 0 0999 V2000 0.0680 1.2620 0.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0050 -0.0090 0.0480 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1990 -0.6410 0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2950 -0.0480 0.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5200 -0.6880 0.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6560 -1.9250 0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5560 -2.5220 -0.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3310 -1.8750 -0.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6870 -3.7350 -1.1750 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5170 -4.2860 -1.7830 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8990 -2.5750 0.0360 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0340 -1.8580 0.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9880 -0.6460 0.1590 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.3610 -2.5620 0.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4320 -1.5690 0.3900 N 0 3 0 0 0 0 0 0 0 0 0 0 -8.9540 -1.1260 1.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9190 -0.2180 1.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9590 -0.1320 -0.1410 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.0220 -0.9760 -0.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0030 -0.9210 -2.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7600 0.3820 -2.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6630 0.5550 -1.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7610 0.5320 2.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5340 0.4160 3.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3220 1.1170 4.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.3380 1.9340 3.9860 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.5680 2.0530 2.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7820 1.3610 1.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.3260 2.8130 5.1110 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0820 1.6550 0.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6230 1.9520 0.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2060 1.1470 1.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1910 0.9150 1.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3720 -0.2240 1.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4780 -2.3340 -1.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7590 -5.2530 -2.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1590 -3.6120 -2.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7420 -4.4160 -1.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9420 -3.5400 -0.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5290 -3.1780 -0.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3560 -3.1940 1.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6600 -1.4350 2.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9780 -0.8740 -2.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5200 -1.7840 -2.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0690 1.2180 -2.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3630 0.2570 -3.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6400 0.1010 -1.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7730 1.6150 -1.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7420 -0.2220 3.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1470 1.0280 5.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.3610 2.6920 2.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9600 1.4580 0.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 19 2 0 0 0 0 16 17 2 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 17 23 1 0 0 0 0 18 19 1 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 28 52 1 0 0 0 0 M CHG 1 15 1 M END