IBS-ZINC05389233 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 1 0 0 0 0 0999 V2000 0.7870 -0.7080 -1.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4060 -0.4180 -0.0560 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9710 -0.0940 -1.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5340 1.0760 -1.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0600 1.4560 -3.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0260 0.6770 -3.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4600 -0.4820 -3.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9340 -0.8730 -1.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4340 -2.1580 -1.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0260 -2.2210 0.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5520 -1.8330 0.2930 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9580 -2.4410 -0.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0860 -2.0540 1.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3570 -3.1850 2.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0710 -3.3880 3.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2280 -2.4590 4.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9560 -1.3280 3.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3810 -1.1230 2.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2370 -3.6180 0.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3450 -4.5680 -0.0270 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3000 -3.7580 2.0560 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2120 -2.8500 2.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9210 -1.4830 2.3270 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8770 -1.2750 0.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4920 -0.3740 0.4720 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0280 -2.9790 4.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6550 -3.1990 2.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5950 1.0860 -5.0420 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.2120 2.1090 -5.5800 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4470 0.3990 -5.5780 O 0 5 0 0 0 0 0 0 0 0 0 0 1.8080 -0.3280 -1.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8030 -1.7810 -0.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3090 -0.5170 -2.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4200 -0.2750 0.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0700 1.0750 -0.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7800 1.6870 -1.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7160 2.3620 -3.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2160 -1.0900 -3.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5210 -2.1970 -1.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0030 -3.0060 -1.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1230 -3.9100 1.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6400 -4.2710 3.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1060 -2.6180 5.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1910 -0.6030 4.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9460 -0.2380 2.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0010 -2.7270 4.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7110 -2.2990 4.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2410 -4.0040 4.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8700 -4.2240 2.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3370 -2.5190 2.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7850 -3.1040 1.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 3 12 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 7 8 2 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 40 1 0 0 0 0 10 41 1 0 0 0 0 11 12 1 0 0 0 0 11 20 1 0 0 0 0 11 25 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 17 18 2 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 19 46 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 27 1 0 0 0 0 23 28 1 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 28 50 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 M CHG 1 29 1 M CHG 1 31 -1 M END