IBS-ZINC02148949 MOE2007 3D CORINA 3.40 0006 02.08.2006 68 73 0 0 1 0 0 0 0 0999 V2000 -2.7150 1.4780 1.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1580 0.1080 1.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0530 -0.8250 2.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5420 -2.0820 2.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1380 -2.4050 0.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2440 -1.4720 -0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7590 -0.2170 0.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4860 -4.0060 0.5990 S 0 0 0 0 0 0 0 0 0 0 0 0 0.3190 -3.8730 -0.5640 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0080 -4.5090 1.8330 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7610 -4.9750 0.1770 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5180 -4.6980 -1.0470 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.0340 -3.8910 -1.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5600 -5.9560 -1.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1700 -6.2800 -2.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6220 -5.9050 -3.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6560 -6.3850 -3.6560 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2520 -6.2430 -4.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9700 -7.0990 -2.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1580 -7.0600 -1.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1270 -7.7030 -0.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0020 -8.3650 -0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1190 -8.4040 -0.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1070 -7.7820 -2.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9220 -4.2880 -0.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2570 -4.2340 0.4740 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8020 -3.9840 -1.6540 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0240 -3.5420 -1.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1720 -2.2350 -0.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3940 -1.7780 -0.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5040 -2.6240 -0.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8350 -2.1570 -0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8880 -3.0480 -0.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6590 -4.3500 -0.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5930 -5.1300 -0.6500 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.4390 -4.7590 -0.9660 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.3640 -3.9430 -0.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1160 -4.3920 -1.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0370 -0.7780 0.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4220 -0.5580 1.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6090 0.7300 2.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4170 1.8040 1.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0360 1.5930 0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8390 0.3100 -0.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9030 2.1470 2.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2110 1.8650 0.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4340 1.4120 2.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3690 -0.5730 3.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4590 -2.8110 3.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9280 -1.7250 -1.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8450 0.5100 -0.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0070 -5.7260 0.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9450 -6.7900 -1.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2120 -5.7830 -2.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1170 -5.3120 -4.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9920 -7.6770 0.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0260 -8.8620 0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0040 -8.9310 -0.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9810 -7.8160 -2.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3140 -1.5810 -0.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5030 -0.7640 -0.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8800 -2.7460 0.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9950 -5.4030 -1.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5730 -1.3950 2.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9070 0.9010 3.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5650 2.8100 1.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8880 2.4350 -0.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5370 0.1470 -1.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 45 1 0 0 0 0 1 46 1 0 0 0 0 1 47 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 48 1 0 0 0 0 4 5 1 0 0 0 0 4 49 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 50 1 0 0 0 0 7 51 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 52 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 25 1 0 0 0 0 14 15 1 0 0 0 0 14 53 1 0 0 0 0 14 54 1 0 0 0 0 15 16 2 0 0 0 0 15 20 1 0 0 0 0 16 17 1 0 0 0 0 16 55 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 21 56 1 0 0 0 0 22 23 2 0 0 0 0 22 57 1 0 0 0 0 23 24 1 0 0 0 0 23 58 1 0 0 0 0 24 59 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 28 38 2 0 0 0 0 29 30 2 0 0 0 0 29 60 1 0 0 0 0 30 31 1 0 0 0 0 30 61 1 0 0 0 0 31 32 1 0 0 0 0 31 37 2 0 0 0 0 32 33 2 0 0 0 0 32 39 1 0 0 0 0 33 34 1 0 0 0 0 33 62 1 0 0 0 0 34 35 2 0 0 0 0 34 36 1 0 0 0 0 36 37 1 0 0 0 0 37 38 1 0 0 0 0 38 63 1 0 0 0 0 39 40 1 0 0 0 0 39 44 2 0 0 0 0 40 41 2 0 0 0 0 40 64 1 0 0 0 0 41 42 1 0 0 0 0 41 65 1 0 0 0 0 42 43 2 0 0 0 0 42 66 1 0 0 0 0 43 44 1 0 0 0 0 43 67 1 0 0 0 0 44 68 1 0 0 0 0 M END