IBS-ZINC02092623 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 58 0 0 1 0 0 0 0 0999 V2000 -0.4650 1.2590 0.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1960 -0.2390 0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5570 -0.7500 1.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8260 -2.2480 1.1230 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3510 -2.4300 0.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6740 -2.7260 2.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2580 -3.5850 3.0140 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8910 -2.1970 2.4760 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5570 -2.5910 3.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4570 -3.6530 3.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1340 -4.0610 4.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9240 -3.4080 5.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6370 -3.8240 7.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3900 -3.1510 8.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4680 -2.0840 8.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2560 -1.4890 9.2640 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8180 -1.7080 7.1100 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0170 -2.3360 5.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3420 -1.9300 4.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3720 -0.7790 4.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6170 -4.9680 7.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4460 -2.9750 1.1190 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1390 -3.1140 -0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7090 -2.6370 -1.0600 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3080 -3.7820 -0.0320 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0000 -3.8920 -1.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2800 -4.6660 -1.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4490 -4.0010 -0.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6230 -4.7110 -0.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6260 -6.0860 -0.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4570 -6.7510 -1.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2840 -6.0410 -1.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4820 1.7910 0.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0020 1.6230 -0.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0670 1.4320 1.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1440 -0.7710 -0.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4050 -0.4120 -0.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5040 -0.2180 1.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0440 -0.5770 2.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6180 -4.1570 2.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8290 -4.8850 4.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8990 -3.4320 9.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3770 -1.1550 5.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6900 -0.0780 5.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3460 -0.2710 3.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6120 -4.5880 6.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6330 -5.4630 8.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3160 -5.6830 6.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7900 -3.3550 1.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2310 -2.8960 -1.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3640 -4.4130 -2.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4470 -2.9260 -0.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5370 -4.1910 -0.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5430 -6.6400 -0.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4590 -7.8250 -1.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3710 -6.5600 -1.5120 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 36 1 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 38 1 0 0 0 0 3 39 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 22 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 19 2 0 0 0 0 10 11 2 0 0 0 0 10 40 1 0 0 0 0 11 12 1 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 12 18 2 0 0 0 0 13 14 2 0 0 0 0 13 21 1 0 0 0 0 14 15 1 0 0 0 0 14 42 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 21 46 1 0 0 0 0 21 47 1 0 0 0 0 21 48 1 0 0 0 0 22 23 1 0 0 0 0 22 49 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 52 1 0 0 0 0 29 30 1 0 0 0 0 29 53 1 0 0 0 0 30 31 2 0 0 0 0 30 54 1 0 0 0 0 31 32 1 0 0 0 0 31 55 1 0 0 0 0 32 56 1 0 0 0 0 M END