IBS-ZINC05322404 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 46 0 0 0 0 0 0 0 0999 V2000 0.4250 1.7570 -0.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2880 0.2470 -0.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9700 -0.2920 1.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8460 -1.7320 1.1460 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7160 -2.6640 0.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1790 -3.8910 1.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8900 -5.0360 0.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0880 -4.8550 -0.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8510 -5.9570 -0.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0370 -5.7680 -1.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4660 -4.4780 -1.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7070 -3.3820 -1.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5210 -3.5370 -0.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8540 -2.4320 -0.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -3.5850 1.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2140 -2.2620 1.7820 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8690 -4.5540 2.2230 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0510 -4.3130 2.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5490 -3.2250 3.1740 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6950 -5.6310 3.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0120 -5.4630 4.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6000 -6.8200 4.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9290 -6.7840 5.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4100 -5.6420 5.4510 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4780 2.0520 -0.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0710 2.1230 -1.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0330 2.2510 0.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7760 -0.0200 -0.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7220 -0.2170 -1.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0390 -0.0470 1.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5330 0.1460 1.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5230 -6.0290 0.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5250 -6.9720 -0.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6240 -6.6230 -1.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3900 -4.3190 -2.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0550 -2.3780 -1.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5830 -5.5120 2.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8630 -6.2240 2.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9780 -6.1760 3.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8490 -4.8600 4.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7260 -4.9070 3.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7580 -7.4150 3.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8800 -7.3660 5.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3840 -7.9260 5.5160 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 16 1 0 0 0 0 5 6 1 0 0 0 0 5 14 2 0 0 0 0 6 7 2 0 0 0 0 6 15 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 11 12 2 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 23 24 2 0 0 0 0 23 44 1 0 0 0 0 M CHG 1 44 -1 M END