IBS-ZINC02094682 MOE2007 3D CORINA 3.40 0006 02.08.2006 66 69 0 0 1 0 0 0 0 0999 V2000 -0.0690 1.6130 0.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 0.0940 0.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3740 -0.4700 0.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2690 -1.9720 -0.0910 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5740 -2.1420 -0.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6270 -2.5100 -0.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1360 -3.3780 0.2080 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2710 -2.0260 -1.5360 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4420 -2.6260 -1.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5920 -2.3620 -1.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7760 -2.9560 -1.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8360 -3.8360 -2.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0930 -4.4880 -2.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0860 -5.3300 -3.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8880 -5.5550 -4.6970 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8960 -6.3130 -5.6500 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7390 -4.9550 -4.3480 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6780 -4.1060 -3.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4840 -3.4890 -2.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3560 -6.0240 -4.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0230 -5.2280 -5.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7180 -5.4800 -6.8270 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3300 -4.7500 -7.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2480 -3.7680 -7.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5540 -3.5170 -6.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9450 -4.2500 -5.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3590 -4.2300 -2.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7830 -2.6570 1.1090 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2310 -3.9580 0.9660 S 0 0 0 0 0 0 0 0 0 0 0 0 0.5610 -4.3570 2.2890 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3670 -4.8300 0.0180 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7260 -3.3770 0.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7910 -3.0110 1.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9630 -2.5560 0.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0700 -2.4660 -0.9130 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0050 -2.8330 -1.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8340 -3.2930 -1.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3480 -1.9680 -1.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9230 2.0150 0.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4540 2.0500 -0.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7380 1.8570 1.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6880 -0.1500 -0.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4030 -0.3440 1.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0200 -0.3040 1.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7960 0.0310 -0.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5460 -1.6840 -0.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6640 -2.7490 -0.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5890 -3.6840 -3.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1180 -7.0210 -4.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0280 -6.1040 -3.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0010 -6.2470 -7.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0910 -4.9470 -8.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7260 -3.1980 -8.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.2710 -2.7500 -5.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1870 -4.0560 -4.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1540 -3.5300 -1.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1120 -3.8060 -2.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7280 -5.1680 -1.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0540 -2.3480 1.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7070 -3.0810 2.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7950 -2.2690 1.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0890 -2.7630 -2.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 -3.5830 -1.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0140 -2.8110 -1.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1200 -1.4710 -2.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8320 -1.2640 -0.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 1 41 1 0 0 0 0 2 3 1 0 0 0 0 2 42 1 0 0 0 0 2 43 1 0 0 0 0 3 4 1 0 0 0 0 3 44 1 0 0 0 0 3 45 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 28 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 46 1 0 0 0 0 11 12 1 0 0 0 0 11 47 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 27 1 0 0 0 0 14 15 1 0 0 0 0 14 20 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 48 1 0 0 0 0 20 21 1 0 0 0 0 20 49 1 0 0 0 0 20 50 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 51 1 0 0 0 0 23 24 1 0 0 0 0 23 52 1 0 0 0 0 24 25 2 0 0 0 0 24 53 1 0 0 0 0 25 26 1 0 0 0 0 25 54 1 0 0 0 0 26 55 1 0 0 0 0 27 56 1 0 0 0 0 27 57 1 0 0 0 0 27 58 1 0 0 0 0 28 29 1 0 0 0 0 28 59 1 0 0 0 0 29 30 2 0 0 0 0 29 31 2 0 0 0 0 29 32 1 0 0 0 0 32 33 1 0 0 0 0 32 37 2 0 0 0 0 33 34 2 0 0 0 0 33 60 1 0 0 0 0 34 35 1 0 0 0 0 34 61 1 0 0 0 0 35 36 2 0 0 0 0 35 38 1 0 0 0 0 36 37 1 0 0 0 0 36 62 1 0 0 0 0 37 63 1 0 0 0 0 38 64 1 0 0 0 0 38 65 1 0 0 0 0 38 66 1 0 0 0 0 M END