PUBCHEM-ZINC06031437 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 0 0 1 0 0 0 0 0999 V2000 -0.1900 1.3460 0.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2360 -0.1700 0.5420 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2090 -0.3170 1.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7830 -0.6880 1.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2740 -0.2810 1.6180 C 0 0 3 0 0 0 0 0 0 0 0 0 3.0810 -0.7370 0.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7780 -1.7480 0.3550 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0290 0.1710 -0.6450 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0170 -0.0370 -1.6720 C 0 0 3 0 0 0 0 0 0 0 0 0 4.1510 -1.1090 -1.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3310 0.5880 -1.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0600 0.9830 -2.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7120 0.6380 -3.0420 C 0 0 3 0 0 0 0 0 0 0 0 0 3.6740 -0.1150 -3.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5910 1.6220 -3.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0530 2.8800 -3.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5420 2.9140 -3.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1800 1.1680 -3.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9740 0.1210 -2.3990 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3110 -0.1300 -2.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2970 0.3340 -2.5940 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3250 -1.0190 -0.7790 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.6090 -1.8630 -0.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7620 -1.9480 -0.8250 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6150 1.1900 1.9710 C 0 0 3 0 0 0 0 0 0 0 0 0 2.3710 1.8730 1.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9880 1.6940 3.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0460 1.2580 2.1510 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2640 2.1650 2.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8240 -1.0570 2.7270 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6980 1.6630 -0.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0700 1.6900 -0.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2110 1.8750 1.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3670 -0.4290 2.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7280 -1.7870 1.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1360 1.4680 -0.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9160 -0.1080 -0.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8050 1.7710 -2.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5140 0.1190 -2.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4420 3.7650 -3.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9770 3.4810 -3.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9040 3.2920 -2.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4840 1.9980 -3.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0330 0.7650 -4.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5070 -1.2390 -0.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6790 -2.4580 -1.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6170 -2.5730 0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6250 -2.5540 -1.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3170 1.0990 4.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3090 2.7220 3.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8960 1.6860 3.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7460 -0.7400 2.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9710 1.4720 -3.3440 N 0 3 0 0 0 0 0 0 0 0 0 0 5.2270 1.3380 -4.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 22 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 25 1 0 0 0 0 5 30 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 13 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 12 53 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 53 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 17 53 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 28 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 27 51 1 0 0 0 0 28 29 1 0 0 0 0 30 52 1 0 0 0 0 53 54 1 0 0 0 0 M CHG 1 53 1 M END