IBS-ZINC03985164 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 1 0 0 0 0 0999 V2000 -3.3140 -6.6640 -6.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2460 -7.0410 -5.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4020 -5.7820 -4.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3330 -6.1590 -3.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4820 -4.9530 -2.3380 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7190 -4.5690 -1.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8350 -3.3160 -1.1110 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.5340 -2.6120 -0.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5210 -1.6030 -0.1020 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3910 -3.1520 -1.2480 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5470 -2.7200 -1.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3880 -4.2680 -1.9860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8740 -4.8590 -2.5240 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.7350 -2.3240 -1.8500 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.7490 -1.3740 -1.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1380 -2.8780 -1.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8840 -2.8200 -3.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1540 -3.4460 -2.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3020 -3.6740 -3.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3560 -4.3180 -2.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2810 -4.7180 -1.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1540 -4.5010 -0.8010 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0800 -3.8560 -1.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8460 -3.4960 -0.9420 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.5230 -3.6540 -0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.4950 -4.5630 -3.6030 O 0 0 0 0 0 0 0 0 0 0 0 0 -13.5530 -5.2280 -2.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4040 -2.1960 -4.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1730 -1.3370 -4.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7010 -5.2020 -2.2810 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2030 -7.5610 -7.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2770 -6.1970 -7.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5120 -5.9640 -7.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0480 -7.7410 -5.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2830 -7.5070 -5.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6000 -5.0820 -4.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3640 -5.3160 -4.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1350 -6.8590 -2.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3710 -6.6250 -2.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3640 -3.3640 -4.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.1310 -5.2150 -1.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1090 -4.8180 0.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.2060 -6.2020 -2.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.8600 -4.6280 -2.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.4000 -5.3620 -3.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1330 -2.9780 -5.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1900 -1.5700 -4.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6900 -1.0340 -4.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4820 -0.4520 -3.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3290 -3.5820 -0.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2260 -2.1160 -3.2150 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.3160 -1.6810 -3.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 12 1 0 0 0 0 6 7 1 0 0 0 0 6 30 2 0 0 0 0 7 8 1 0 0 0 0 7 14 1 0 0 0 0 7 50 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 51 1 0 0 0 0 16 17 2 0 0 0 0 16 24 1 0 0 0 0 17 18 1 0 0 0 0 17 28 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 26 1 0 0 0 0 21 22 2 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 26 27 1 0 0 0 0 27 43 1 0 0 0 0 27 44 1 0 0 0 0 27 45 1 0 0 0 0 28 29 1 0 0 0 0 28 46 1 0 0 0 0 28 47 1 0 0 0 0 29 48 1 0 0 0 0 29 49 1 0 0 0 0 29 51 1 0 0 0 0 51 52 1 0 0 0 0 M END