IBS-ZINC05163628 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 59 0 0 1 0 0 0 0 0999 V2000 -4.7480 -4.1070 0.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4510 -3.6970 0.2620 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3500 -2.4310 -0.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4340 -1.6810 -0.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2240 -0.4250 -1.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9360 0.0870 -1.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8470 -0.6540 -0.9670 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0390 -1.9190 -0.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8240 -2.7070 0.1060 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0920 -2.2590 -0.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7710 -2.7300 1.6640 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.7280 -3.1190 2.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6310 -1.3160 2.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7560 -0.7100 2.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8500 -1.6310 2.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7430 -3.0350 2.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3420 -3.6480 2.2120 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2230 -5.0420 1.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2570 -5.0260 0.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8220 -4.1630 -1.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2340 -5.4850 -2.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5930 -5.8520 -2.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0270 -7.0700 -3.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1130 -7.9410 -3.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7650 -7.5940 -3.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3270 -6.3750 -3.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3620 -6.0250 -3.2890 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.1180 -3.8000 3.6200 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6350 -5.0510 1.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1910 -3.3790 1.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4000 -4.2910 -0.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4540 -2.0460 -0.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0710 0.1520 -1.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7800 1.0650 -1.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8500 -0.2290 -1.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3910 -0.6330 1.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8280 -1.3810 3.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9260 -0.5060 1.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8110 0.2550 2.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8330 -1.2060 2.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7850 -1.6870 3.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0050 -2.9820 0.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4990 -3.6680 2.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0250 -5.6890 1.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7100 -5.5140 1.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2140 -4.6670 -0.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0800 -6.0400 -0.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1680 -3.8240 -2.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5310 -3.4100 -2.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3330 -5.1860 -2.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0800 -7.3380 -3.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4520 -8.8890 -4.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0610 -8.2820 -4.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8470 -4.3220 4.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8280 -4.1400 -0.4550 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.7450 -4.5170 -0.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 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 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 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 7 2 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 55 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 17 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 17 18 1 0 0 0 0 17 28 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 19 55 1 0 0 0 0 20 21 1 0 0 0 0 20 48 1 0 0 0 0 20 49 1 0 0 0 0 20 55 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 50 1 0 0 0 0 23 24 1 0 0 0 0 23 51 1 0 0 0 0 24 25 2 0 0 0 0 24 52 1 0 0 0 0 25 26 1 0 0 0 0 25 53 1 0 0 0 0 26 27 1 0 0 0 0 28 54 1 0 0 0 0 55 56 1 0 0 0 0 M CHG 1 55 1 M END