IFLAB-ZINC04339594 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 58 0 0 0 0 0 0 0 0999 V2000 1.1810 0.3320 1.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6180 -0.6420 0.6950 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3610 -1.0050 -0.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5950 -0.4680 -0.7590 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2440 -0.9240 -1.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6640 -1.9200 -2.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4220 -2.4700 -2.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7820 -2.0040 -1.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9180 -3.4330 -3.1830 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2960 -4.0660 -2.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3660 -2.3650 -3.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4680 -1.6000 -5.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1340 -2.0200 -6.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7080 -3.0650 -6.5020 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9500 -0.8870 -7.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3540 -0.6970 -8.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0220 0.5210 -9.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3020 1.4960 -8.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8830 1.2900 -6.9860 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2390 0.0810 -6.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9450 -0.3170 -5.1340 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1530 2.3380 -6.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8240 4.4560 -6.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0660 5.2470 -7.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3300 4.4760 -7.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9940 3.0940 -8.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1050 2.3110 -7.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9630 2.6870 -8.9100 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1260 -0.0200 1.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3110 1.2900 1.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4800 0.4880 2.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0800 0.3060 -0.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2080 -0.4970 -2.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1800 -2.3990 -0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1910 -4.5720 -1.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1250 -3.3520 -2.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5260 -4.8290 -3.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7640 -3.3760 -3.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9060 -1.4610 -8.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3270 0.6970 -10.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6130 1.9170 -5.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8910 3.0570 -5.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7720 4.9810 -6.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3390 4.2790 -5.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3380 6.2020 -6.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4920 5.4840 -8.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9650 4.3720 -6.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9080 5.0390 -8.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9190 2.5350 -8.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4890 3.1990 -9.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6090 2.1120 -6.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2020 1.3650 -7.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4010 2.7200 -9.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1370 3.1150 -7.0100 N 0 3 0 0 0 0 0 0 0 0 0 0 1.6310 3.2790 -7.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 11 12 2 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 21 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 18 19 2 0 0 0 0 18 28 1 0 0 0 0 19 20 1 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 22 54 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 23 54 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 27 54 1 0 0 0 0 28 53 1 0 0 0 0 54 55 1 0 0 0 0 M CHG 1 54 1 M END