OTAVA-ZINC04746605 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 38 0 0 0 0 0 0 0 0999 V2000 -0.3640 1.0270 -0.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1650 -0.3500 -0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1330 -0.8690 -0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2530 -0.0210 -0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0310 1.3640 -0.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7320 1.8840 -0.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5610 -0.5660 -0.0740 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7640 0.1280 -0.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0400 1.3100 -0.1360 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7550 -0.9680 -0.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0470 -0.9740 -0.1030 N 0 0 0 0 0 0 0 0 0 0 0 0 7.6900 0.2110 -0.1380 N 0 0 0 0 0 0 0 0 0 0 0 0 9.1050 0.2540 -0.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8750 -0.9220 -0.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2700 -0.8750 -0.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9220 0.3530 -0.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1770 1.5320 -0.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7700 1.5030 -0.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9880 2.7970 -0.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7180 2.6810 -0.1960 O 0 5 0 0 0 0 0 0 0 0 0 0 4.9690 -2.2390 -0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7010 -1.9590 -0.0420 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5570 -3.4640 -0.0260 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3710 1.4330 -0.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0160 -1.0230 -0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2560 -1.9490 -0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8540 2.0720 -0.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5810 2.9600 -0.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2490 1.1720 -0.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3810 -1.8900 -0.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8440 -1.7970 -0.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0070 0.3970 -0.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6930 2.4900 -0.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5690 -3.5460 -0.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9960 -4.3040 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6430 3.8860 -0.2440 O 0 0 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 24 1 0 0 0 0 2 3 2 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 26 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 27 1 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 22 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 10 21 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 29 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 30 1 0 0 0 0 15 16 1 0 0 0 0 15 31 1 0 0 0 0 16 17 2 0 0 0 0 16 32 1 0 0 0 0 17 18 1 0 0 0 0 17 33 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 36 2 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 34 1 0 0 0 0 23 35 1 0 0 0 0 M CHG 1 20 -1 M END