IFLAB-ZINC04280044 MOE2007 3D CORINA 3.40 0006 02.08.2006 34 34 0 0 1 0 0 0 0 0999 V2000 0.0090 0.9920 0.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4520 1.0680 2.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8910 3.0080 1.2490 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2770 3.3300 0.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7940 3.5410 2.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2140 3.1070 2.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4780 2.4370 1.1340 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1910 3.4630 2.9670 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.5250 3.1390 2.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8280 1.9470 2.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1430 1.6280 1.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1590 2.5000 2.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8570 3.6920 2.7650 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5430 4.0080 3.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4540 2.1860 1.8480 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5060 3.5430 1.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3770 2.8220 1.8610 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0440 -0.0960 0.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0360 1.3090 0.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3180 1.3580 -0.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5790 1.3670 2.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 -0.0190 2.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1010 1.5050 3.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4590 3.1460 3.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7440 4.6300 2.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9710 3.9440 3.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0360 1.2690 1.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3790 0.7010 1.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6490 4.3700 3.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3080 4.9340 3.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8960 1.6900 2.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8640 1.5400 1.3020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7820 4.8200 1.1280 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6920 5.1180 1.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 32 1 0 0 0 0 2 21 1 0 0 0 0 2 22 1 0 0 0 0 2 23 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 16 1 0 0 0 0 3 32 1 0 0 0 0 5 6 1 0 0 0 0 5 24 1 0 0 0 0 5 25 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 26 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 27 1 0 0 0 0 11 12 1 0 0 0 0 11 28 1 0 0 0 0 12 13 2 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 29 1 0 0 0 0 14 30 1 0 0 0 0 15 31 1 0 0 0 0 16 17 2 0 0 0 0 16 33 1 0 0 0 0 33 34 1 0 0 0 0 M END