PUBCHEM-ZINC06005959 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 1 0 0 0 0 0999 V2000 -4.6070 -2.8590 2.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5220 -1.3370 2.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5840 -0.8080 1.2000 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.8940 -0.5020 -0.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0720 -0.5720 -0.8350 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0700 -0.1800 -2.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9080 0.2880 -2.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7340 0.3650 -2.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7180 -0.0280 -0.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7430 -0.0750 0.2870 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8140 0.1870 0.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3260 -0.5530 1.4190 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 -2.3450 -0.7280 3.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9230 -2.1240 2.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3200 -2.3860 4.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0610 -3.0270 5.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5080 -3.2670 6.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7870 -2.8660 6.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5290 -2.2250 5.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9770 -1.9890 4.3510 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 -0.0120 0.5220 2.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5540 0.9520 4.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3190 0.6680 5.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4520 2.0180 4.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5260 2.7010 5.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4670 3.6940 5.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3360 4.0160 4.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2680 3.3430 3.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3350 2.3430 3.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2470 -3.2600 2.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0260 -3.1120 1.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6090 -3.2880 2.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5080 -0.9020 2.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1750 -1.0830 3.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9820 -0.9350 -0.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9810 -0.2360 -2.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9220 0.5940 -3.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8330 0.7300 -2.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6500 -2.9030 2.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1360 -2.1270 1.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0730 -3.3410 4.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0870 -3.7680 7.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2200 -3.0530 7.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5410 -1.9110 5.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5580 -1.4920 3.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1520 2.4520 6.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5250 4.2230 6.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0700 4.7950 4.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9490 3.5980 2.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2860 1.8160 2.3200 H 0 0 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 35 1 0 0 0 0 2 36 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 37 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 7 8 2 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 8 40 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 41 1 0 0 0 0 15 42 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 43 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 19 20 2 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 21 47 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 48 1 0 0 0 0 28 29 1 0 0 0 0 28 49 1 0 0 0 0 29 30 2 0 0 0 0 29 50 1 0 0 0 0 30 31 1 0 0 0 0 30 51 1 0 0 0 0 31 52 1 0 0 0 0 M CHG 1 3 1 M END