IBS-ZINC00502340 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 47 0 0 1 0 0 0 0 0999 V2000 -0.2020 1.6210 -0.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1030 0.1320 -0.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 -0.4500 0.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1450 -1.8390 0.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1600 -2.6860 -0.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0520 -2.0860 -1.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0720 -0.6970 -1.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2820 -4.1000 -0.3530 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1780 -5.0300 -1.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2610 -4.9460 -2.5470 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8000 -6.2510 -0.8360 C 0 0 3 0 0 0 0 0 0 0 0 0 1.8640 -5.9400 -0.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7820 -7.7470 -1.1560 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6180 -8.1100 -2.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0300 -8.2260 -0.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2450 -8.6880 -0.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2160 -8.9710 0.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9630 -8.7800 1.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7290 -8.3060 1.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7720 -8.0370 0.9710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3420 -7.5560 1.0930 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2140 -7.8740 1.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1230 -6.1710 0.5370 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9740 -6.0570 0.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5180 -4.7760 0.8710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8830 -4.3980 1.9660 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6900 -8.2400 -0.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7990 2.0560 -1.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7750 1.8860 -1.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7150 2.0670 -0.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 0.1710 1.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2210 -2.2240 1.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0720 -2.6690 -2.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1440 -0.2710 -2.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4550 -8.8180 -1.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1920 -9.3390 -0.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7480 -9.0080 2.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5460 -8.1670 2.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8860 -9.0260 -1.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9150 -7.2670 -0.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2770 -8.4150 0.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2490 -8.3270 -0.1700 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.0460 -9.3280 -0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 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 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 25 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 23 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 42 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 35 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 18 19 2 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 42 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 25 26 2 0 0 0 0 27 39 1 0 0 0 0 27 40 1 0 0 0 0 27 41 1 0 0 0 0 27 42 1 0 0 0 0 42 43 1 0 0 0 0 M CHG 1 42 1 M END