PUBCHEM-ZINC03697520 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 1 0 0 0 0 0999 V2000 -0.0480 1.7100 0.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0130 0.3370 -0.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4100 0.0800 -0.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7080 -0.6660 -0.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5070 -2.1570 -0.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4650 -2.6650 0.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1110 -1.9380 0.0950 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6180 -2.1750 -0.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2640 -2.3450 1.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6640 -3.4050 1.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1720 -3.2790 2.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4310 -2.2720 3.3040 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3450 -1.6110 2.3980 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3740 -1.8850 4.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1070 -0.6080 5.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1920 -0.2050 6.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1850 -1.0820 7.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6380 -2.3650 7.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7270 -2.7690 5.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0930 -0.6730 8.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -0.3410 9.8380 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2010 -3.9520 3.2580 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8200 -5.1180 2.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7850 -6.1480 2.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0690 -5.8410 0.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0950 -4.3920 0.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9190 2.2070 0.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8100 2.3540 0.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2450 1.6360 1.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1290 0.3950 -1.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8150 -0.2380 0.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0600 -0.0580 -1.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5550 1.1470 -0.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0810 -0.4620 0.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4690 -0.3050 -1.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4550 -2.6830 -0.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1920 -2.3690 -1.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8690 -2.5690 1.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3140 -3.7410 0.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4070 0.0980 4.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5560 0.7940 6.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9090 -3.0680 7.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0150 -3.7980 5.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6180 -3.6610 4.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4790 -4.8170 1.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4630 -5.5840 3.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2790 -7.1220 2.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0320 -6.2800 2.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5130 -6.4660 0.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0270 -6.1760 0.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4530 -4.3200 -0.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1060 -4.1330 0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3190 -0.4100 0.0940 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.5640 -0.2250 1.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 2 53 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 3 53 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 6 39 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 53 1 0 0 0 0 9 10 1 0 0 0 0 9 13 2 0 0 0 0 10 11 2 0 0 0 0 10 26 1 0 0 0 0 11 12 1 0 0 0 0 11 22 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 19 43 1 0 0 0 0 20 21 3 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 53 54 1 0 0 0 0 M CHG 1 53 1 M END