PUBCHEM-ZINC06912720 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 1 0 0 0 0 0999 V2000 -0.4600 0.2820 2.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2930 -0.5000 1.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4100 0.1310 -0.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2860 -0.5840 -1.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0520 -1.9670 -1.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 -2.6220 -0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0730 -1.8840 1.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2880 -3.9930 -0.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3280 -4.1780 -1.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1110 -2.9250 -2.2790 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0570 -2.6620 -3.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5630 -5.4000 -2.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8040 -5.4060 -3.6870 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4860 -6.5670 -1.7500 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7280 -7.8930 -2.3170 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2290 -7.9280 -3.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2230 -8.1480 -2.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1100 -8.9210 -1.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1390 -8.5920 -0.1830 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1240 -10.1940 -1.8340 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0580 -10.6450 -3.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0100 -11.8270 -3.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7960 -12.4790 -1.8830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5070 -11.3040 -0.9370 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4030 -10.9960 -0.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5750 -11.8080 0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7560 -11.3980 -0.1370 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5070 0.2600 2.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1620 -0.1350 3.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1550 1.3250 2.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5980 1.2020 -0.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3730 -0.0650 -2.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0030 -2.3950 2.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4310 -4.7590 0.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0580 -2.8070 -4.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6640 -3.3450 -4.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2680 -1.6380 -3.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2430 -6.5570 -0.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7310 -8.0990 -1.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4230 -9.1360 -2.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6880 -7.4020 -3.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3470 -9.8660 -3.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9710 -10.9600 -3.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0460 -11.4740 -3.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8150 -12.5070 -4.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6730 -13.0520 -1.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0490 -13.1760 -1.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1440 -12.6160 0.9390 O 0 5 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 5 6 2 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 33 1 0 0 0 0 8 9 2 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 18 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 23 24 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 26 27 2 0 0 0 0 26 48 1 0 0 0 0 M CHG 1 48 -1 M END