IBS-ZINC04084386 MOE2007 3D CORINA 3.40 0006 02.08.2006 62 62 0 0 1 0 0 0 0 0999 V2000 0.7990 -0.3780 -1.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0050 0.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0200 1.5170 0.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4310 -0.5250 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4190 -2.0550 0.0030 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7630 -2.4080 -0.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8170 -2.5660 -0.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3500 -3.2700 0.5910 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9310 -2.5480 1.2940 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3610 -3.7660 1.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2520 -4.4540 0.3850 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1420 -4.2730 2.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9070 -3.5970 3.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7390 -5.6700 2.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2490 -6.1840 3.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0870 -6.2510 4.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6780 -6.9270 4.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5100 -4.8540 5.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -4.3390 3.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5970 -6.7660 6.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5330 -6.9430 7.1270 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3220 -7.3910 8.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8040 -7.6470 8.7520 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4850 -7.5730 9.3220 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.3310 -7.9920 8.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8800 -6.2180 9.9130 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1360 -6.3820 10.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6040 -4.7760 11.4720 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.0880 -5.1690 12.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8200 -0.0080 -1.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8150 -1.4630 -1.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3310 0.0690 -1.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4700 -0.4530 1.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6610 1.7870 1.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9910 1.8780 0.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4080 1.9700 -0.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0260 -0.1710 0.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8640 -0.1590 -0.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0180 -1.9970 2.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 -6.3460 2.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5670 -5.6220 1.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6740 -7.1800 3.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0140 -5.5080 4.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3380 -4.9010 5.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2550 -4.1780 5.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4460 -3.3440 3.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7860 -5.0150 3.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1020 -7.7210 6.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2970 -6.0450 6.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4340 -6.7380 6.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0650 -5.8410 10.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0800 -5.5140 9.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9510 -6.7600 10.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9360 -7.0870 11.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8540 -5.5770 11.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8390 -5.9040 13.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4630 -4.2630 12.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8970 -9.4080 10.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4690 -2.2400 -1.3600 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1000 -8.4870 10.4050 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3170 -8.1210 10.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3640 -2.5920 -1.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 2 0 0 0 0 7 59 1 0 0 0 0 9 10 1 0 0 0 0 9 39 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 19 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 20 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 46 1 0 0 0 0 19 47 1 0 0 0 0 20 21 1 0 0 0 0 20 48 1 0 0 0 0 20 49 1 0 0 0 0 21 22 1 0 0 0 0 21 50 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 60 1 0 0 0 0 26 27 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 27 28 1 0 0 0 0 27 53 1 0 0 0 0 27 54 1 0 0 0 0 28 29 1 0 0 0 0 29 55 1 0 0 0 0 29 56 1 0 0 0 0 29 57 1 0 0 0 0 58 60 1 0 0 0 0 59 62 1 0 0 0 0 60 61 1 0 0 0 0 M END