IBS-ZINC04814834 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 0 0 0 0 0 0999 V2000 0.0350 1.7870 0.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0050 0.2740 0.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4240 -1.8390 1.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 -2.4520 2.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9720 -0.8500 2.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2760 -0.1910 1.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3220 -2.9170 3.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8340 -3.0300 3.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3060 -3.0650 2.2180 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7100 -3.1000 4.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0350 -2.6710 4.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5530 -2.9200 5.7960 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5770 -3.4300 6.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4180 -3.5870 5.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2840 -4.1590 6.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3250 -4.5170 7.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4800 -4.3220 8.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6230 -3.7810 7.9890 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9280 -2.6830 6.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8430 -2.0500 3.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0390 2.1880 0.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6170 2.2260 -0.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3190 2.1250 1.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0310 -0.0740 0.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4380 -0.0820 -0.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6950 -2.3280 0.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6580 -1.9080 1.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8030 -2.0040 3.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9280 -3.5210 2.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0520 -0.7230 2.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6970 -0.3110 3.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4890 0.8810 1.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5920 -0.6410 0.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9560 -3.9440 3.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1200 -2.3540 4.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3650 -4.3410 5.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4470 -4.9520 8.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5010 -4.6020 9.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5230 -3.6450 8.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0240 -1.6300 6.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1900 -3.3230 7.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5890 -2.9300 5.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2130 -1.4510 2.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6090 -1.3750 3.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3340 -2.8270 2.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7670 -0.3620 1.2310 N 0 3 0 0 0 0 0 0 0 0 0 0 0.4670 0.0940 2.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6290 -2.2790 2.4440 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 24 1 0 0 0 0 2 25 1 0 0 0 0 2 46 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 3 46 1 0 0 0 0 4 28 1 0 0 0 0 4 29 1 0 0 0 0 4 48 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 5 31 1 0 0 0 0 5 48 1 0 0 0 0 6 32 1 0 0 0 0 6 33 1 0 0 0 0 6 46 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 7 48 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 20 1 0 0 0 0 12 13 1 0 0 0 0 12 19 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 15 16 1 0 0 0 0 15 36 1 0 0 0 0 16 17 2 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 39 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 46 47 1 0 0 0 0 M CHG 1 46 1 M END