IBS-ZINC02139950 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 0 0 1 0 0 0 0 0999 V2000 -0.1050 1.0700 0.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2390 1.4410 2.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1950 1.9570 4.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4920 3.4170 3.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0340 4.1530 4.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3280 5.4960 4.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0770 6.1100 3.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5320 5.3710 2.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2380 4.0220 2.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6370 3.2650 1.4460 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4200 3.5190 1.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3570 3.6590 0.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8410 3.4580 0.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2700 2.9420 1.3360 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7660 3.8860 -0.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2750 4.4830 -1.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1490 4.8820 -2.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5140 4.6970 -2.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0130 4.1100 -1.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1490 3.6960 -0.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6380 3.1140 0.5450 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2860 5.9670 1.2290 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 6.5600 1.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4490 7.4220 3.5510 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5480 7.7020 4.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8560 6.4220 5.5420 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3400 0.0100 0.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9730 1.2110 0.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4530 1.4320 -0.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7450 1.8880 3.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1620 0.3560 3.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1240 1.3880 4.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7370 1.8330 5.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2300 3.6760 5.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1560 4.7070 -0.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9980 3.0380 -0.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2130 4.6300 -2.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7700 5.3420 -3.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1920 5.0140 -3.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0780 3.9700 -1.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8470 3.7390 1.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1510 7.3360 1.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7720 5.7960 1.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0660 6.9990 0.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5990 8.0780 5.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3500 8.4140 5.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7720 1.8200 1.6520 N 0 0 0 0 0 0 0 0 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 47 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 2 47 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 26 1 0 0 0 0 7 8 2 0 0 0 0 7 24 1 0 0 0 0 8 9 1 0 0 0 0 8 22 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 47 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 19 2 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 M END