IBS-ZINC02223694 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 56 0 0 0 0 0 0 0 0999 V2000 -1.3750 1.6700 0.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0710 0.1950 0.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0380 -0.4880 1.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7590 -1.8410 1.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5140 -2.5130 0.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5470 -1.8310 -1.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8300 -0.4780 -1.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1570 -4.2380 0.1950 S 0 0 0 0 0 0 0 0 0 0 0 0 0.4640 -4.5370 -1.0480 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4510 -4.5050 1.4510 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6070 -5.0390 0.1980 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2620 -5.3730 -1.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2730 -6.8700 -1.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3580 -7.5870 -0.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3380 -9.0390 -1.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4280 -9.8320 -0.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3780 -11.1840 -0.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2550 -11.7780 -1.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1700 -11.0160 -1.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1980 -9.6380 -1.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1270 -8.8510 -1.9910 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3420 -9.2650 -2.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1570 -7.5180 -1.8190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1940 -6.8530 -2.1600 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2060 -5.3950 1.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5480 -6.2470 2.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1400 -6.5990 3.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3930 -6.1020 3.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0520 -5.2510 2.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4580 -4.8930 1.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9760 -6.4490 4.9900 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2670 -5.9000 5.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4460 2.2340 0.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8700 1.9260 -0.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0290 1.9180 0.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2300 0.0370 2.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7330 -2.3740 2.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3550 -2.3560 -1.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8600 0.0540 -1.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2860 -5.0010 -1.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7160 -4.9130 -1.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2180 -7.0990 -0.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3050 -9.3780 -0.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2190 -11.7970 -0.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2310 -12.8480 -1.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3000 -11.4880 -2.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5720 -6.6350 2.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6280 -7.2620 4.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0280 -4.8640 3.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9690 -4.2260 1.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2040 -4.8110 5.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9660 -6.2130 4.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6160 -6.2550 6.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 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 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 7 39 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 25 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 13 14 2 0 0 0 0 13 23 1 0 0 0 0 14 15 1 0 0 0 0 14 42 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 43 1 0 0 0 0 17 18 1 0 0 0 0 17 44 1 0 0 0 0 18 19 2 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 23 24 2 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 28 29 2 0 0 0 0 28 31 1 0 0 0 0 29 30 1 0 0 0 0 29 49 1 0 0 0 0 30 50 1 0 0 0 0 31 32 1 0 0 0 0 32 51 1 0 0 0 0 32 52 1 0 0 0 0 32 53 1 0 0 0 0 M END