IBS-ZINC02201504 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 58 0 0 0 0 0 0 0 0999 V2000 -2.2360 -4.9590 4.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3880 -4.8820 3.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6710 -3.7170 3.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0860 -3.6090 2.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1680 -4.6280 1.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4170 -5.8730 1.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2500 -5.9600 2.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1460 -7.4180 2.8900 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.1280 -7.1340 0.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8340 -4.2600 -0.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5940 -3.1560 -0.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7090 -2.2160 0.8850 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4820 -1.2710 0.8350 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8140 -2.4070 1.9220 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5800 -4.9830 -1.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1260 -5.9130 -3.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6060 -5.9110 -3.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8320 -3.5340 -2.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3530 -3.5370 -2.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5310 -4.5090 -4.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9560 -3.2170 -4.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5060 -2.8800 -6.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8810 -1.6690 -6.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7060 -0.7850 -6.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1660 -1.1130 -4.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7950 -2.3230 -4.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2760 -5.1800 4.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8520 -5.7290 5.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2350 -4.0100 5.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6960 -2.8830 3.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9030 -7.1330 0.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1750 -8.0310 1.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8320 -7.2550 -0.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1150 -2.8310 -1.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1490 -4.5380 -2.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8910 -6.0280 -1.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8300 -6.9100 -2.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4790 -5.5990 -3.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7470 -6.5280 -4.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2470 -6.2790 -2.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4800 -3.8400 -1.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1130 -2.5330 -3.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7100 -3.1700 -3.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2220 -2.9140 -1.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1450 -4.7550 -3.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6360 -5.3240 -5.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8740 -3.5570 -6.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5390 -1.4150 -7.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0010 0.1560 -6.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8210 -0.4250 -4.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1770 -2.5580 -3.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8840 -4.9470 -1.9520 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.4300 -5.2710 -1.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0750 -4.5050 -3.8660 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.5410 -4.1730 -4.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 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 30 1 0 0 0 0 4 5 1 0 0 0 0 4 14 1 0 0 0 0 5 6 2 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 9 31 1 0 0 0 0 9 32 1 0 0 0 0 9 33 1 0 0 0 0 10 11 2 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 15 52 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 16 52 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 17 54 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 18 54 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 19 52 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 20 46 1 0 0 0 0 20 54 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 23 48 1 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 51 1 0 0 0 0 52 53 1 0 0 0 0 54 55 1 0 0 0 0 M CHG 1 52 1 M CHG 1 54 1 M END