IBS-ZINC02295547 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 54 0 0 1 0 0 0 0 0999 V2000 1.3370 1.3320 -0.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6970 -0.1530 -0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8510 -0.4440 -1.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1200 -0.5080 1.3630 C 0 0 3 0 0 0 0 0 0 0 0 0 2.9870 0.0900 1.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4750 -1.9710 1.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8680 -2.7060 2.1750 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0150 -0.2300 2.2840 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1010 -0.2290 1.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2680 0.0260 3.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4030 -0.0710 4.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1750 0.4210 4.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4400 0.7510 5.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6640 1.0070 6.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9150 0.4160 6.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9460 0.6600 7.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7460 1.4900 8.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5060 2.0800 8.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4660 1.8390 7.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7660 1.7270 9.3310 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4920 2.5900 10.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1410 0.4570 4.0060 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7070 -0.6590 3.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1100 -1.7160 3.5500 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0550 -0.5960 2.9010 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6440 -1.7500 2.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9020 -1.6850 1.8190 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5800 -0.4790 1.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0010 0.6680 2.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7460 0.6160 2.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2030 1.9300 0.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0350 1.5850 -1.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5140 1.5390 0.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8300 -0.7510 -0.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7180 0.1540 -0.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1080 -1.5020 -0.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5500 -0.1910 -2.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4630 0.8260 6.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0710 -0.2290 5.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9120 0.2040 7.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3560 2.7250 9.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4990 2.2930 7.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3890 2.6940 11.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6900 2.1650 11.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1890 3.5700 10.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6460 1.2850 4.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1160 -2.6910 2.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3590 -2.5770 1.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5640 -0.4340 1.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5350 1.6060 2.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2970 1.5110 3.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4660 -2.4580 0.6700 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6580 -3.4030 0.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 8 1 0 0 0 0 6 7 2 0 0 0 0 6 52 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 22 1 0 0 0 0 13 14 1 0 0 0 0 13 38 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 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 28 29 2 0 0 0 0 28 49 1 0 0 0 0 29 30 1 0 0 0 0 29 50 1 0 0 0 0 30 51 1 0 0 0 0 52 53 1 0 0 0 0 M END