IBS-ZINC02135664 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 55 0 0 1 0 0 0 0 0999 V2000 0.8320 1.3690 0.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4690 -0.0020 0.4900 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2680 -0.7970 1.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1830 -0.3000 2.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8780 -1.1720 3.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6560 -2.5440 2.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7470 -3.0530 2.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0630 -2.1920 1.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1630 -2.7460 0.2150 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3690 -2.4390 -1.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2060 -1.6630 -1.6000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4690 -3.2710 -2.0800 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.8640 -3.4130 -1.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9080 -3.7620 -0.2320 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7670 -4.1490 0.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8890 -3.5580 0.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0040 -4.0190 1.8140 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8600 -3.1660 -2.2260 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4200 -2.7440 -3.5280 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5710 -2.3490 -3.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7630 -3.7800 -4.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6100 -3.6000 -5.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6510 -4.8170 -6.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3350 -5.2530 -7.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1360 -6.5600 -7.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2680 -7.4250 -7.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5730 -7.0130 -6.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7860 -5.7060 -5.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2380 -5.0440 -4.6490 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4480 -5.4590 -4.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3140 -2.3100 -5.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6230 -1.1650 -5.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8740 1.4840 0.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2000 1.8190 -0.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6400 1.9000 1.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3620 0.7630 2.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5830 -0.7760 3.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1890 -3.2180 3.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5960 -4.1290 2.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0160 -4.2740 -2.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0130 -4.5900 -8.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6630 -6.9020 -8.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1260 -8.4350 -7.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1040 -7.6900 -5.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3340 -2.0780 -6.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3530 -2.4020 -5.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6490 -0.9090 -5.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2530 -0.2710 -5.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3740 -1.5650 -3.6940 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.2910 -1.8570 -3.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0370 -0.7550 -3.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 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 36 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 6 7 2 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 16 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 19 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 18 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 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 49 1 0 0 0 0 21 22 2 0 0 0 0 21 29 1 0 0 0 0 22 23 1 0 0 0 0 22 31 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 41 1 0 0 0 0 25 26 1 0 0 0 0 25 42 1 0 0 0 0 26 27 2 0 0 0 0 26 43 1 0 0 0 0 27 28 1 0 0 0 0 27 44 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 31 32 1 0 0 0 0 31 45 1 0 0 0 0 31 46 1 0 0 0 0 32 47 1 0 0 0 0 32 48 1 0 0 0 0 32 49 1 0 0 0 0 49 50 1 0 0 0 0 49 51 1 0 0 0 0 M CHG 1 49 1 M END