IBS-ZINC04312188 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 56 0 0 1 0 0 0 0 0999 V2000 -0.0510 1.5020 0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0140 -0.0040 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1110 -0.7010 1.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1450 -2.0910 1.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 -2.7820 -0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0690 -2.1010 -1.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1110 -0.7010 -1.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2510 0.0330 -2.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4860 -0.7170 -3.7560 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1960 0.1820 -4.7810 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3850 1.1640 -4.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2980 0.3050 -5.9290 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8350 -0.3830 -5.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7440 -0.4430 -6.5420 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8330 -1.0650 -4.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7100 -1.7570 -3.9560 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5990 1.0830 -7.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1050 2.4960 -6.9550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1820 2.8430 -7.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5930 4.1540 -7.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7130 5.0660 -6.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5040 4.7000 -6.2500 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9310 3.4630 -6.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4960 -0.4510 -5.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6880 -0.0240 -4.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8800 -0.6040 -5.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8790 -1.6120 -5.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6870 -2.0390 -6.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4960 -1.4550 -6.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1770 1.2440 -2.4800 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2680 -2.7750 2.3370 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2970 -4.2010 2.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9450 1.8920 -0.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7450 1.8540 -0.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3800 1.8500 0.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1820 -0.1670 2.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0820 -3.8620 -0.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1390 -2.6420 -2.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1030 0.6310 -7.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6760 1.0930 -7.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8480 2.1100 -7.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5880 4.4600 -7.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0260 6.0890 -6.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9360 3.2020 -6.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6880 0.7640 -3.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8110 -0.2700 -4.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8100 -2.0660 -6.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6870 -2.8260 -7.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5650 -1.7860 -6.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0700 -1.6180 -3.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6290 -4.5570 1.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1430 -4.5120 1.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3980 -4.6230 3.2520 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 5 6 2 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 30 2 0 0 0 0 9 10 1 0 0 0 0 9 15 1 0 0 0 0 9 50 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 24 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 22 2 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 45 1 0 0 0 0 26 27 1 0 0 0 0 26 46 1 0 0 0 0 27 28 2 0 0 0 0 27 47 1 0 0 0 0 28 29 1 0 0 0 0 28 48 1 0 0 0 0 29 49 1 0 0 0 0 31 32 1 0 0 0 0 32 51 1 0 0 0 0 32 52 1 0 0 0 0 32 53 1 0 0 0 0 M END