PUBCHEM-ZINC06005955 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 58 0 0 1 0 0 0 0 0999 V2000 -4.4700 -2.9410 1.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2870 -1.4430 1.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0600 -1.2230 0.7530 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.9610 -1.2910 -0.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8760 -1.5600 -1.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4650 -1.5550 -2.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1430 -1.2840 -3.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2220 -1.0160 -2.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6220 -1.0160 -0.9270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9750 -0.7940 0.2720 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0370 -0.5780 0.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8990 -0.9280 1.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6190 -0.7620 2.7330 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.5400 -0.4910 3.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0830 -2.0770 3.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9190 -1.9490 4.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9650 -2.2800 5.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8140 -2.1620 7.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6180 -1.7150 7.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4290 -1.3850 6.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2800 -1.5070 5.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6230 0.2950 2.9240 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3180 0.0680 2.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0130 1.5820 3.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1920 1.8660 2.9300 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0080 2.6480 3.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3480 2.3260 3.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2810 3.3260 3.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8760 4.6460 3.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5350 4.9730 3.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4080 3.9830 3.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1040 6.4130 3.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3420 -3.0990 2.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6160 -3.4540 0.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5840 -3.3380 2.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1410 -1.0620 0.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2170 -0.9200 2.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9080 -1.7730 -1.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1750 -1.7640 -3.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8330 -1.2830 -4.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1940 -0.8060 -2.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7850 -2.8810 3.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1180 -2.3030 2.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9000 -2.6290 5.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6320 -2.4200 7.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5000 -1.6220 8.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3640 -1.0350 7.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0980 -1.2530 4.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6640 1.2960 3.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3290 3.0770 3.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6110 5.4250 3.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4540 4.2390 3.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0930 6.8570 2.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8960 6.4650 4.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8020 6.9600 4.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 36 1 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 12 2 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 38 1 0 0 0 0 6 7 1 0 0 0 0 6 39 1 0 0 0 0 7 8 2 0 0 0 0 7 40 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 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 22 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 19 20 2 0 0 0 0 19 46 1 0 0 0 0 20 21 1 0 0 0 0 20 47 1 0 0 0 0 21 48 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 24 25 2 0 0 0 0 24 26 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 27 49 1 0 0 0 0 28 29 1 0 0 0 0 28 50 1 0 0 0 0 29 30 2 0 0 0 0 29 51 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 31 52 1 0 0 0 0 32 53 1 0 0 0 0 32 54 1 0 0 0 0 32 55 1 0 0 0 0 M CHG 1 3 1 M END