IBS-ZINC02145620 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 0 0 1 0 0 0 0 0999 V2000 -0.3140 0.9420 0.8190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2320 -0.4080 0.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1140 -1.0170 0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2810 -0.4230 0.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5340 -1.0470 0.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6450 -2.2820 -0.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4950 -2.8830 -0.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2580 -2.2490 -0.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1540 -2.9320 -1.0920 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1310 -2.4200 -0.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0930 -3.0780 -1.3580 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2910 -1.0670 -0.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7280 -0.5750 -0.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1560 0.0650 -1.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8330 -0.6860 -2.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2170 -0.1030 -3.8390 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9270 1.2360 -4.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2540 1.9930 -3.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8700 1.4120 -1.9250 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7940 -2.9970 -0.3940 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9980 -2.4450 0.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1840 -3.3620 -0.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0880 -4.4380 -0.7540 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3710 -2.8430 0.3000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.6960 -3.4830 0.1830 C 0 0 3 0 0 0 0 0 0 0 0 0 9.5500 -4.5690 0.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4480 -3.0030 -1.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8170 -3.6820 -1.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6460 -3.2480 -2.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5430 -3.0920 1.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2680 -1.9400 1.9000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 0.8800 1.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2960 1.6760 0.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3220 1.3560 0.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2530 0.5400 1.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3990 -0.5350 0.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5620 -3.8480 -1.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4080 -1.4030 -0.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9110 0.1320 0.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0620 -1.7350 -2.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7390 -0.6970 -4.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2250 1.6880 -5.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0280 3.0380 -3.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3460 2.0220 -1.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2050 -1.4790 -0.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9290 -2.3280 1.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4110 -1.9610 0.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6210 -1.9200 -1.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7200 -4.7730 -1.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2950 -3.3920 -2.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5020 -3.3920 -0.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7270 -2.6550 -2.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2250 -2.9570 -3.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3810 -4.3050 -2.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3560 -3.9630 1.8530 O 0 5 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 12 2 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 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 6 7 2 0 0 0 0 6 20 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 9 10 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 13 14 1 0 0 0 0 13 38 1 0 0 0 0 13 39 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 40 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 17 18 2 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 30 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 48 1 0 0 0 0 28 49 1 0 0 0 0 28 50 1 0 0 0 0 28 51 1 0 0 0 0 29 52 1 0 0 0 0 29 53 1 0 0 0 0 29 54 1 0 0 0 0 30 31 2 0 0 0 0 30 55 1 0 0 0 0 M CHG 1 55 -1 M END