IFLAB-ZINC02457540 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3770 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 1.2150 -0.6810 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4060 0.0350 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3800 1.4160 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1460 3.5930 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8470 4.1210 -1.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8220 5.6510 -1.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5470 6.1660 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8460 5.6380 1.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8710 4.1080 1.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2380 -2.0770 -0.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6180 -2.5810 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6000 -4.1020 -0.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7340 -4.6920 0.8060 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3800 -4.1440 0.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4850 -2.6220 1.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1710 -5.7070 1.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2910 -6.1460 1.4250 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2670 -6.2970 2.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -7.4250 3.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0960 -8.0150 4.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0200 -7.5780 4.5600 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9030 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9250 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3510 -0.4880 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 1.9730 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1130 3.9390 0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8810 3.7740 -1.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3310 3.7540 -2.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3220 6.0270 -2.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7890 5.9970 -1.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5800 5.8190 -0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5300 7.2560 0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3620 6.0050 2.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8130 5.9840 1.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3710 3.7320 2.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9040 3.7620 1.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1640 -2.1180 -0.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1040 -2.3380 0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2080 -4.3430 -1.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6120 -4.4950 -0.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2260 -4.3890 0.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0770 -4.5650 1.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0010 -2.3780 2.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5150 -2.1880 1.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9890 -5.5230 3.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3690 -6.6930 2.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2780 -8.1990 2.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8980 -7.0290 3.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5310 -9.0260 5.1770 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9150 -9.3720 5.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 13 1 0 0 0 0 4 5 2 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 13 14 1 0 0 0 0 13 18 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 19 1 0 0 0 0 17 18 1 0 0 0 0 17 44 1 0 0 0 0 17 45 1 0 0 0 0 18 46 1 0 0 0 0 18 47 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 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 50 1 0 0 0 0 22 51 1 0 0 0 0 23 24 2 0 0 0 0 23 52 1 0 0 0 0 52 53 1 0 0 0 0 M END