PUBCHEM-ZINC05563637 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 1 0 0 0 0 0999 V2000 -0.2470 1.5710 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1000 0.0480 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7100 -0.3810 1.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4650 -0.5880 0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9140 -1.5420 -0.7820 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2020 -1.8630 -0.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1590 -2.7480 -0.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3860 -2.8300 -0.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6690 -2.0360 0.8450 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7400 -1.1600 1.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4900 -1.0590 0.7130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3840 -0.3080 0.9550 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.2480 0.6690 2.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1690 -2.1220 -1.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3960 -3.3510 -1.4200 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2340 -3.0750 -0.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4780 -3.8820 -2.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2860 -4.9570 -2.0740 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1280 -5.5450 -2.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9410 -6.5950 -2.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7960 -7.1920 -3.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8410 -6.7440 -4.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0270 -5.6950 -5.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1690 -5.1000 -4.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6830 -7.3310 -5.6720 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6770 -6.8180 -7.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3180 -4.3640 -1.0150 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7410 2.0310 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8240 1.8760 -0.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7610 1.8900 0.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4150 -0.2720 -0.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2590 0.0390 2.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7140 -1.4690 1.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7340 -0.0200 1.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9440 -3.3680 -1.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1310 -3.5180 -0.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6340 -2.1110 1.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9710 -0.5460 2.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6430 1.6310 1.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8050 0.3260 2.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1960 0.7790 2.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8650 -2.4150 -2.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4700 -1.3830 -2.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1570 -4.2400 -3.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1200 -3.0820 -2.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9060 -6.9440 -1.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4290 -8.0090 -3.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0620 -5.3450 -6.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5330 -4.2860 -4.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9560 -5.7640 -6.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3920 -7.3740 -7.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6790 -6.9240 -7.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9130 -4.6590 -1.7180 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 4 1 0 0 0 0 2 31 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 12 2 0 0 0 0 5 6 1 0 0 0 0 5 14 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 9 10 2 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 27 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 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 46 1 0 0 0 0 21 22 1 0 0 0 0 21 47 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 48 1 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 27 53 1 0 0 0 0 M CHG 1 12 1 M END