IBS-ZINC03882116 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 60 0 0 1 0 0 0 0 0999 V2000 -0.1730 1.3200 -0.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1670 -0.0790 0.1170 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7480 -0.5360 1.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6690 0.2440 1.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5550 -0.3520 2.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5270 -1.7310 2.8350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6050 -2.5370 2.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7200 -1.9200 1.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5720 -4.0460 2.3390 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7230 -4.4790 1.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8510 -4.6730 1.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8140 -5.3200 2.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8550 -5.7300 1.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0750 -6.4170 1.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8840 -6.6630 0.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4950 -6.2370 -0.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2890 -5.5540 -0.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4890 -5.3140 0.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2730 -4.6720 0.5410 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7760 -4.2600 -0.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6400 -5.4930 4.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1390 -5.5300 4.3570 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6970 -6.4680 3.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3900 -4.4470 3.7530 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4490 -3.9280 4.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4270 -3.1390 4.3210 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7050 -4.4800 5.9030 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7660 -5.3700 5.8150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3380 -6.0000 6.6960 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0100 -4.1720 7.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9500 -3.1310 7.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6510 -2.8340 8.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4420 -3.5680 9.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5090 -4.6070 9.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1910 -4.9010 8.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1980 -3.2510 10.8050 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0230 -2.2840 10.7630 O 0 5 0 0 0 0 0 0 0 0 0 0 0.7840 1.6450 -0.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9500 1.5160 -0.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4230 1.8900 0.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7270 1.3190 1.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2700 0.2610 3.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2330 -2.1760 3.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0120 -2.5170 0.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3880 -6.7530 2.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8260 -7.1920 0.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1380 -6.4370 -1.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9880 -5.2220 -1.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1180 -6.4140 4.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1170 -4.6550 4.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1660 -2.4990 6.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3680 -2.0140 8.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3190 -5.2040 10.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8830 -5.7360 8.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9500 -3.9730 11.8220 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 1 40 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 41 1 0 0 0 0 5 6 1 0 0 0 0 5 42 1 0 0 0 0 6 7 2 0 0 0 0 6 43 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 44 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 24 1 0 0 0 0 11 12 2 0 0 0 0 11 19 1 0 0 0 0 12 13 1 0 0 0 0 12 21 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 45 1 0 0 0 0 15 16 1 0 0 0 0 15 46 1 0 0 0 0 16 17 2 0 0 0 0 16 47 1 0 0 0 0 17 18 1 0 0 0 0 17 48 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 21 22 1 0 0 0 0 21 49 1 0 0 0 0 21 50 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 28 1 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 30 1 0 0 0 0 28 29 2 0 0 0 0 30 31 1 0 0 0 0 30 35 2 0 0 0 0 31 32 2 0 0 0 0 31 51 1 0 0 0 0 32 33 1 0 0 0 0 32 52 1 0 0 0 0 33 34 2 0 0 0 0 33 36 1 0 0 0 0 34 35 1 0 0 0 0 34 53 1 0 0 0 0 35 54 1 0 0 0 0 36 37 1 0 0 0 0 36 55 2 0 0 0 0 M CHG 1 37 -1 M END