IBS-ZINC02444184 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 46 0 0 1 0 0 0 0 0999 V2000 0.4070 0.0220 2.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8230 -1.2170 1.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9400 -1.3020 0.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6510 -0.1490 0.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2250 1.0910 0.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1080 1.1750 1.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 -0.2610 -0.4960 C 0 0 3 0 0 0 0 0 0 0 0 0 3.9900 -1.2960 -0.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6610 0.6390 -1.7510 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2650 1.7580 -1.6960 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0890 0.1050 0.2280 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4060 1.0510 0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7680 -0.7320 1.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4270 -1.8820 1.3380 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0010 -0.0740 1.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8180 -1.0310 2.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0700 -0.3490 3.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8560 -1.2590 3.8980 N 0 0 0 0 0 0 0 0 0 0 0 0 10.8820 -2.0030 3.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2120 -1.9730 2.1620 O 0 0 0 0 0 0 0 0 0 0 0 0 11.5890 -2.8730 4.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6560 -3.6770 3.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2990 -4.4900 4.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8730 -4.4950 6.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8030 -3.6850 6.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1490 -2.8630 5.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0840 -2.0680 6.0230 N 0 0 0 0 0 0 0 0 0 0 0 0 9.4940 -1.3220 5.2140 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4630 0.0880 2.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2800 -2.1180 1.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2590 -2.2760 0.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7640 2.0000 0.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7850 2.1420 2.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6160 0.3020 0.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6760 0.7870 2.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2030 -1.4020 3.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1020 -1.9130 1.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6910 0.0070 2.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8030 0.5240 3.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9840 -3.6710 2.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1300 -5.1190 4.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3720 -5.1280 6.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4770 -3.6960 7.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9550 0.1490 -2.6780 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 11 1 0 0 0 0 9 10 2 0 0 0 0 9 44 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 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 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 28 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 24 25 2 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 M CHG 1 44 -1 M END