IBS-ZINC02244987 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 51 0 0 0 0 0 0 0 0999 V2000 1.0380 -0.5820 -0.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0040 -0.0070 0.0280 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.6400 0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2470 -0.1360 0.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4700 -0.7780 0.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6500 -1.9290 0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6010 -2.4330 -0.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3810 -1.7870 -0.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8900 -2.5810 0.0350 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0270 -1.8670 0.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9840 -0.6550 0.1590 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.3520 -2.5750 0.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4260 -1.5850 0.3870 N 0 3 0 0 0 0 0 0 0 0 0 0 -8.9490 -1.1440 1.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9170 -0.2380 1.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9560 -0.1510 -0.1430 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.0160 -0.9920 -0.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9960 -0.9360 -2.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7570 0.3660 -2.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6610 0.5360 -1.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7610 0.5080 2.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5340 0.3920 3.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3250 1.0900 4.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.3420 1.9050 3.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.5720 2.0250 2.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7840 1.3360 1.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.3340 2.7800 5.1090 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.9430 0.0200 -0.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2410 -1.5960 -0.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7190 -0.6070 -1.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1070 0.7600 1.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2850 -0.3850 1.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7410 -3.3280 -1.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5660 -2.1770 -1.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9300 -3.5470 -0.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5180 -3.1910 -0.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3460 -3.2070 1.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6560 -1.4530 2.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9710 -0.8860 -2.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5110 -1.8000 -2.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0680 1.2030 -2.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3580 0.2400 -3.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6360 0.0790 -1.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7740 1.5950 -1.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7420 -0.2440 3.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1510 1.0010 5.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.3670 2.6620 2.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9610 1.4330 0.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 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 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 17 2 0 0 0 0 14 15 2 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 21 1 0 0 0 0 16 17 1 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 19 42 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 26 2 0 0 0 0 22 23 2 0 0 0 0 22 45 1 0 0 0 0 23 24 1 0 0 0 0 23 46 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 26 48 1 0 0 0 0 M CHG 1 13 1 M END