IBS-ZINC05561704 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 51 0 0 0 0 0 0 0 0999 V2000 -1.5470 1.0160 0.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7240 -0.2360 0.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -0.6990 1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7960 -1.8480 1.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7910 -2.5370 -0.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -2.0760 -1.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7390 -0.9240 -1.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -2.7710 -2.4190 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1380 -4.1140 -2.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1560 -4.7270 -1.3810 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2490 -4.8520 -3.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3980 -6.6280 -3.4160 S 0 0 0 0 0 0 0 0 0 0 0 0 0.5090 -7.2280 -5.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4680 -6.3550 -6.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5580 -6.8620 -7.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6820 -8.1570 -7.6330 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7230 -9.0160 -6.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6440 -8.5700 -5.3160 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7200 -9.6820 -4.4710 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8470 -10.7670 -5.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8460 -10.4100 -6.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9690 -11.3320 -7.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9840 -12.2880 -7.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0940 -13.1450 -8.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1990 -13.0560 -9.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1900 -12.1100 -9.8350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0660 -11.2520 -8.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5150 -5.9220 -8.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9510 1.8820 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4300 0.9540 -0.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8550 1.1190 1.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 -0.1620 2.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3920 -2.2060 1.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3820 -3.4340 -0.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3390 -0.5650 -1.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0750 -2.2880 -3.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6410 -4.6640 -4.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1310 -4.5050 -4.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3660 -5.2930 -5.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9290 -11.7720 -4.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6840 -12.3580 -6.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8790 -13.8860 -8.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2890 -13.7290 -10.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5050 -12.0450 -10.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7240 -10.5170 -8.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5270 -5.6030 -8.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0740 -6.4330 -9.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0890 -5.0500 -8.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 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 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 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 8 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 15 16 2 0 0 0 0 15 28 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 21 2 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 25 26 2 0 0 0 0 25 43 1 0 0 0 0 26 27 1 0 0 0 0 26 44 1 0 0 0 0 27 45 1 0 0 0 0 28 46 1 0 0 0 0 28 47 1 0 0 0 0 28 48 1 0 0 0 0 M END