IBS-ZINC02407738 MOE2007 3D CORINA 3.40 0006 02.08.2006 29 28 0 0 1 0 0 0 0 0999 V2000 -0.0070 1.5170 0.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0820 -0.0020 0.0720 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7260 -0.2940 -0.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7160 -0.4970 1.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0810 -1.1400 2.1540 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2410 -0.5980 -0.1520 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9180 -0.5580 -1.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4950 -0.0280 -2.3640 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1410 -1.1850 -1.2600 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0250 -1.2570 -2.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3670 -1.8800 -2.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2840 -1.9400 -3.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5220 -2.5310 -2.8720 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.4320 -2.6190 -3.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9790 1.9680 0.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4270 1.9400 -0.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6500 1.8310 0.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6070 -1.0700 0.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4090 -1.6030 -0.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1610 -0.2400 -2.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5170 -1.8410 -3.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2250 -2.8900 -1.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8550 -1.3100 -1.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4680 -0.9310 -3.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8260 -2.5460 -4.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0190 -3.2470 -4.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3570 -3.0770 -3.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6640 -1.6220 -4.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9350 -0.2120 1.5720 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 6 1 0 0 0 0 4 5 2 0 0 0 0 4 29 1 0 0 0 0 6 7 1 0 0 0 0 6 18 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 19 1 0 0 0 0 10 11 1 0 0 0 0 10 20 1 0 0 0 0 10 21 1 0 0 0 0 11 12 1 0 0 0 0 11 22 1 0 0 0 0 11 23 1 0 0 0 0 12 13 1 0 0 0 0 12 24 1 0 0 0 0 12 25 1 0 0 0 0 13 14 1 0 0 0 0 14 26 1 0 0 0 0 14 27 1 0 0 0 0 14 28 1 0 0 0 0 M CHG 1 29 -1 M END