IFLAB-ZINC02966453 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 46 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.7020 1.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0850 1.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -2.7780 -0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 -2.0920 -1.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6970 -1.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0320 -0.0090 -2.3960 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.1100 0.3480 -3.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5230 0.0780 -2.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4540 0.0750 -3.7530 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2370 1.3550 -4.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8550 1.3090 -5.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8540 1.0060 -4.1990 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5710 1.3620 -4.2240 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1580 0.4350 -3.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7700 2.8090 -3.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7600 3.5880 -4.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7380 4.8860 -3.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7310 5.1620 -2.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2710 3.7320 -2.7760 S 0 0 0 0 0 0 0 0 0 0 0 0 1.1440 1.0810 -5.5030 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1670 2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -2.6260 2.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -3.8580 -0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -2.6340 -2.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5630 -0.8910 -2.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8290 0.8610 -1.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2350 -0.7920 -4.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4910 0.0280 -3.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0050 1.4330 -5.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2950 2.2190 -3.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8400 0.5320 -5.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6330 2.2750 -5.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8360 0.9850 -2.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6670 -0.4150 -3.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5200 3.2310 -4.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4800 5.6200 -4.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5550 6.1190 -2.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0830 1.2990 -5.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 26 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 5 6 2 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 16 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 22 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 17 18 2 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 19 20 2 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 22 43 1 0 0 0 0 M CHG 1 8 1 M END