IBS-ZINC06760055 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 59 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5290 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7400 -0.5110 1.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2480 -0.3230 1.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7040 -1.1180 -0.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9900 -0.6170 -1.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2700 -1.6310 -2.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5950 0.7240 -1.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2400 -0.1840 2.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9130 -0.7350 3.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7400 -1.8410 3.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3670 -2.3570 4.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1650 -1.7720 5.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3310 -0.6630 6.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7070 -0.1300 4.9080 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9170 0.9680 5.0030 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2830 1.1860 6.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1340 1.5840 6.2080 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0310 0.9220 7.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0750 -0.0270 7.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8170 -0.3120 8.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5110 0.3250 9.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4740 1.2430 9.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7410 1.5560 8.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9410 -2.4260 2.3680 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4640 -0.4820 0.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9060 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8900 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8810 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4010 0.0420 2.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5210 -1.5710 1.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4880 0.7300 0.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7820 -1.0030 -0.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4760 -2.1750 -0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8900 -2.6110 -2.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7740 -1.3030 -3.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3440 -1.6940 -2.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6560 0.5920 -2.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0850 1.0810 -2.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4750 1.4530 -1.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0950 0.8900 2.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8650 -0.3760 1.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0130 -3.2180 4.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6520 -2.1740 6.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6260 -1.0260 8.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0860 0.1050 10.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2490 1.7300 10.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9380 2.2750 8.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6910 -2.0660 1.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0310 -0.1010 -0.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4920 -1.5710 0.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9020 -0.1090 1.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5560 -0.5130 -1.2350 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0660 -1.3280 -1.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9360 -0.8370 2.2680 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3610 -0.7290 3.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 53 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 55 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 53 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 7 37 1 0 0 0 0 8 38 1 0 0 0 0 8 39 1 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 9 41 1 0 0 0 0 9 42 1 0 0 0 0 9 55 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 25 1 0 0 0 0 12 13 1 0 0 0 0 12 43 1 0 0 0 0 13 14 2 0 0 0 0 13 44 1 0 0 0 0 14 15 1 0 0 0 0 14 20 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 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 45 1 0 0 0 0 22 23 2 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 24 48 1 0 0 0 0 25 49 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 53 54 1 0 0 0 0 55 56 1 0 0 0 0 M END