IBS-ZINC05219487 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 53 0 0 1 0 0 0 0 0999 V2000 -0.4560 1.9280 1.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6030 2.7930 4.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0580 4.3490 2.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9340 4.5510 0.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9070 6.0120 0.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6470 6.1980 -0.7350 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0780 6.4820 -0.7770 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.5710 5.6490 -0.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4230 6.4320 -2.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1540 6.2690 -2.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0650 6.0860 -1.9780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9020 5.8510 -2.2610 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9490 6.2660 -4.1930 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6250 6.4860 -2.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7890 6.4290 -4.2070 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.8650 6.6060 -2.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5030 7.8410 -1.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6450 7.9120 -1.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1830 6.8550 -0.5220 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.5580 5.6680 -0.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4100 5.4910 -1.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4160 7.8050 -0.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3070 7.8320 0.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6440 9.0370 1.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0930 10.2340 1.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2080 10.2200 0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8660 9.0200 -0.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5310 11.6980 -0.5000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.5340 0.9360 2.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5910 2.2220 1.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9760 1.9260 0.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4540 3.0710 4.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7380 1.7580 4.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1850 3.4600 4.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 4.5760 1.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4150 4.9870 3.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5870 3.9200 0.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9660 4.2490 1.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3170 6.6700 1.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8690 6.3150 0.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7370 6.4870 -4.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1150 8.7330 -2.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1710 8.8530 -1.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0190 4.8340 -0.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9580 4.5090 -1.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7610 6.9130 1.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3440 9.0450 2.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3610 11.1680 1.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1720 9.0370 -1.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1350 2.9160 2.6830 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.1300 2.6550 2.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 50 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 2 50 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 3 50 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 39 1 0 0 0 0 5 40 1 0 0 0 0 6 7 1 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 7 22 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 1 0 0 0 0 10 13 2 0 0 0 0 11 12 2 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 25 26 2 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 27 49 1 0 0 0 0 50 51 1 0 0 0 0 M CHG 1 50 1 M END