OTAVA-ZINC05222796 MOE2007 3D CORINA 3.40 0006 02.08.2006 64 69 0 0 1 0 0 0 0 0999 V2000 -0.2020 1.0940 0.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0330 -0.1810 -0.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2460 -0.7280 -0.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3710 -0.0010 0.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1890 1.2790 0.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9080 1.8240 0.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7600 -0.5800 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2210 -0.6830 -1.4880 C 0 0 3 0 0 0 0 0 0 0 0 0 3.5260 -1.3330 -2.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6080 -1.3520 -1.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6210 -0.7130 -1.8530 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5630 -2.7310 -1.3540 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6650 -3.5660 -1.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3250 -4.9180 -1.1210 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3640 -5.2240 -1.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2610 -5.9430 -1.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9310 -7.1220 -0.9220 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6190 -5.4530 -0.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8210 -4.0970 -1.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8880 -3.1250 -1.2360 N 0 0 0 0 0 0 0 0 0 0 0 0 10.1800 -3.9380 -1.0610 N 0 0 0 0 0 0 0 0 0 0 0 0 10.7200 -5.1980 -0.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7980 -6.1400 -0.8930 N 0 0 0 0 0 0 0 0 0 0 0 0 10.9260 -2.6830 -1.1260 C 0 0 3 0 0 0 0 0 0 0 0 0 10.2510 -1.9370 -1.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5130 -2.2500 0.2490 C 0 0 3 0 0 0 0 0 0 0 0 0 11.1010 -2.9020 1.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0020 -2.6050 0.0850 C 0 0 3 0 0 0 0 0 0 0 0 0 13.1760 -3.6260 0.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2620 -2.5550 -1.4150 C 0 0 3 0 0 0 0 0 0 0 0 0 13.9810 -3.3310 -1.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0150 -2.8820 -2.0650 O 0 0 0 0 0 0 0 0 0 0 0 0 13.7540 -1.2150 -1.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0100 -1.3540 -3.3670 O 0 0 0 0 0 0 0 0 0 0 0 0 13.2210 -1.8070 -3.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8200 -1.7180 0.8400 O 0 0 0 0 0 0 0 0 0 0 0 0 13.1600 -0.9900 0.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4310 -0.9310 0.4200 O 0 5 0 0 0 0 0 0 0 0 0 0 4.2840 0.5870 -2.2120 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8710 0.7120 -3.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3650 -0.1170 -4.2500 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1260 2.0880 -3.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8960 2.7350 -5.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2480 4.0860 -5.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8140 4.7450 -4.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0390 4.0650 -2.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6830 2.7360 -2.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7860 1.7690 -1.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2390 2.0430 -0.6290 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1990 1.5180 0.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8990 -0.7520 -0.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3520 -1.7260 -0.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0450 1.8650 0.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7780 2.8180 1.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4780 -0.0060 0.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7560 -1.5780 0.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6530 -3.1600 -1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7880 -5.3650 -0.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0100 -0.4220 -1.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6870 -0.9000 -1.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4610 2.2190 -5.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0860 4.6380 -6.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0820 5.7960 -4.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4780 4.5620 -1.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 50 1 0 0 0 0 2 3 2 0 0 0 0 2 51 1 0 0 0 0 3 4 1 0 0 0 0 3 52 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 53 1 0 0 0 0 6 54 1 0 0 0 0 7 8 1 0 0 0 0 7 55 1 0 0 0 0 7 56 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 39 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 57 1 0 0 0 0 13 14 1 0 0 0 0 13 20 2 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 2 0 0 0 0 18 23 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 24 1 0 0 0 0 22 23 2 0 0 0 0 22 58 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 32 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 38 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 28 36 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 30 33 1 0 0 0 0 33 34 1 0 0 0 0 33 59 1 0 0 0 0 33 60 1 0 0 0 0 34 35 1 0 0 0 0 36 37 1 0 0 0 0 39 40 1 0 0 0 0 39 48 1 0 0 0 0 40 41 2 0 0 0 0 40 42 1 0 0 0 0 42 43 1 0 0 0 0 42 47 2 0 0 0 0 43 44 2 0 0 0 0 43 61 1 0 0 0 0 44 45 1 0 0 0 0 44 62 1 0 0 0 0 45 46 2 0 0 0 0 45 63 1 0 0 0 0 46 47 1 0 0 0 0 46 64 1 0 0 0 0 47 48 1 0 0 0 0 48 49 2 0 0 0 0 M CHG 1 38 -1 M END