PUBCHEM-ZINC05919354 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 1 0 0 0 0 0999 V2000 1.0600 1.9790 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1920 0.7280 -0.0510 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8650 1.0000 -0.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6030 -0.1460 -1.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2900 -1.1570 -1.0900 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1680 0.3200 -2.4590 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3760 -0.3710 -3.7420 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3150 -0.9330 -3.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8090 -1.2820 -4.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0010 -2.4520 -3.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0370 -2.4460 -2.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2040 -3.5220 -1.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3380 -4.6120 -1.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3040 -4.6280 -2.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1360 -3.5530 -3.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4260 0.6400 -4.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1120 1.7610 -4.6610 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3530 -0.0950 1.1430 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2210 0.2130 2.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9080 1.2140 2.5270 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0910 -0.7470 3.3070 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2640 -0.7830 4.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9980 0.2590 5.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3400 0.2290 6.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9530 -0.8450 7.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2190 -1.9060 6.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1410 -1.8980 5.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8840 -3.0150 5.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2490 -4.0720 5.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8860 -4.0510 7.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1560 -2.9750 7.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1210 1.7200 0.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9390 2.5860 -0.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8010 2.6030 0.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3180 1.2110 -2.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7370 -0.6940 -4.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6870 -1.6870 -5.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7140 -1.5980 -2.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0050 -3.5050 -0.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4640 -5.4450 -0.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3770 -5.4730 -2.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6800 -3.5710 -3.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9170 -0.9290 1.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6380 -1.5120 2.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3220 1.1230 4.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9090 1.0480 7.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2320 -0.8450 8.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1990 -3.0980 3.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8170 -4.9090 5.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 -4.8690 7.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1200 -2.9780 8.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9880 0.2300 -5.9720 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 18 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 16 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 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 39 1 0 0 0 0 13 14 2 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 15 42 1 0 0 0 0 16 17 2 0 0 0 0 16 52 1 0 0 0 0 18 19 1 0 0 0 0 18 43 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 44 1 0 0 0 0 22 23 2 0 0 0 0 22 27 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 24 25 2 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 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 28 29 1 0 0 0 0 28 48 1 0 0 0 0 29 30 2 0 0 0 0 29 49 1 0 0 0 0 30 31 1 0 0 0 0 30 50 1 0 0 0 0 31 51 1 0 0 0 0 M CHG 1 52 -1 M END