IBS-ZINC06661688 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 0 0 0 0 0 0 0 0999 V2000 -0.0240 1.5450 -0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0360 0.0220 -0.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5590 -0.5690 0.9520 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6280 -1.9250 0.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7480 -2.5860 0.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8070 -3.9820 0.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7670 -4.7000 1.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3410 -4.0460 1.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4120 -2.6640 1.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5000 -2.0290 2.0530 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5290 -2.8500 2.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8590 -1.8130 -0.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8040 -0.5990 -0.1540 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9350 -2.4530 -0.6200 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0380 -1.6850 -1.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1770 -2.6350 -1.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7000 -3.3340 -0.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2810 -2.2850 0.6310 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3160 -1.5600 -0.0350 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8760 -0.8480 -1.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3180 -1.8380 -2.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6710 -3.6660 -2.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2530 -3.2790 -3.8150 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7890 -4.2250 -4.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7430 -5.5580 -4.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1620 -5.9450 -3.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6300 -4.9990 -2.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8930 0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4780 1.9960 -0.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5900 1.8320 0.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0640 -0.3260 -0.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5300 -0.2650 -1.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6680 -4.4970 0.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8160 -5.7780 1.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1520 -4.6180 1.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9160 -3.5180 1.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1210 -3.4390 3.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3370 -2.2190 2.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9790 -3.4210 -0.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6880 -1.1650 -2.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3980 -0.9570 -0.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8800 -3.8580 0.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4770 -4.0470 -0.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4940 -1.5970 0.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6930 -2.7810 1.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0960 -0.1400 -0.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7160 -0.3080 -1.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1080 -2.5210 -2.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9420 -1.2930 -3.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2890 -2.2380 -4.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4620 -3.9220 -5.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3800 -6.2960 -5.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1260 -6.9860 -2.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9610 -5.3020 -1.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 12 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 2 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 21 1 0 0 0 0 16 22 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 20 47 1 0 0 0 0 21 48 1 0 0 0 0 21 49 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 50 1 0 0 0 0 24 25 1 0 0 0 0 24 51 1 0 0 0 0 25 26 2 0 0 0 0 25 52 1 0 0 0 0 26 27 1 0 0 0 0 26 53 1 0 0 0 0 27 54 1 0 0 0 0 M END