BACHEM-ZINC02517113 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 59 0 0 1 0 0 0 0 0999 V2000 -1.0450 0.0630 -2.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3090 -0.3490 -0.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3150 0.7680 0.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0050 -1.5840 -0.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0420 -0.7900 -1.1470 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9590 0.0520 -1.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7660 1.2210 -1.9870 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1320 -0.6180 -1.8350 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3810 -0.0780 -2.3800 C 0 0 3 0 0 0 0 0 0 0 0 0 4.4520 0.9810 -2.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4660 -0.2520 -3.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5250 0.6770 -4.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7400 0.5680 -6.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2420 -0.3870 -6.7380 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2480 1.6820 -6.7780 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3620 1.6680 -8.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7610 2.9590 -8.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4990 2.8780 -10.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6750 1.9960 -10.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5830 2.1200 -12.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3020 3.1170 -13.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1230 4.0100 -12.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2150 3.8880 -10.9540 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9640 4.6630 -9.9890 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7220 4.1430 -8.6970 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3070 4.7080 -7.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1540 5.8040 -7.7530 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4020 6.3200 -9.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8050 5.7500 -10.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6140 -0.8430 -1.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3520 -2.0030 -1.3730 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6320 0.9800 -2.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9550 -0.7130 -2.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1080 0.2420 -1.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3320 0.9920 0.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2890 0.4880 1.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1120 1.6980 -0.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9880 -2.4190 -0.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4830 -1.9320 0.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0480 -1.3770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1870 -1.5830 -1.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4920 -0.0630 -4.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2460 -1.2950 -4.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4790 0.4280 -4.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7130 1.7130 -4.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4170 1.5590 -8.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8060 0.7980 -8.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8320 3.2320 -8.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1120 1.2290 -10.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9470 1.4400 -12.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2150 3.1960 -14.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6680 4.7790 -12.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1160 4.3150 -6.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6280 6.2670 -6.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0650 7.1740 -9.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0010 6.1600 -11.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7110 -0.2180 -1.8610 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 41 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 30 1 0 0 0 0 11 12 1 0 0 0 0 11 42 1 0 0 0 0 11 43 1 0 0 0 0 12 13 1 0 0 0 0 12 44 1 0 0 0 0 12 45 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 16 17 1 0 0 0 0 16 46 1 0 0 0 0 16 47 1 0 0 0 0 17 18 1 0 0 0 0 17 25 1 0 0 0 0 17 48 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 49 1 0 0 0 0 20 21 1 0 0 0 0 20 50 1 0 0 0 0 21 22 2 0 0 0 0 21 51 1 0 0 0 0 22 23 1 0 0 0 0 22 52 1 0 0 0 0 23 24 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 26 27 1 0 0 0 0 26 53 1 0 0 0 0 27 28 2 0 0 0 0 27 54 1 0 0 0 0 28 29 1 0 0 0 0 28 55 1 0 0 0 0 29 56 1 0 0 0 0 30 31 2 0 0 0 0 30 57 1 0 0 0 0 M CHG 1 57 -1 M END