PUBCHEM-ZINC06904584 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5270 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7700 -0.4920 -1.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1410 0.0340 -1.1920 N 0 5 0 0 0 0 0 0 0 0 0 0 2.1480 1.5020 -1.2310 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6410 1.8430 -2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4210 2.0490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5710 1.9970 -1.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4660 1.2740 -0.8510 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8490 3.2440 -1.6660 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2320 3.7250 -1.6700 C 0 0 3 0 0 0 0 0 0 0 0 0 5.9120 2.8800 -1.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5220 4.4330 -2.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5800 5.6310 -3.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7670 6.5700 -1.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 5.8000 -0.6550 C 0 0 3 0 0 0 0 0 0 0 0 0 3.4740 5.4320 -0.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4260 4.6660 -0.5590 N 0 5 0 0 0 0 0 0 0 0 0 0 4.6970 6.6900 0.4920 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 6.7020 1.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8300 5.9750 1.4540 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0030 7.6170 2.6780 C 0 0 3 0 0 0 0 0 0 0 0 0 4.3770 8.5800 2.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0180 6.9930 3.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2060 7.9170 4.8450 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8500 8.1420 5.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8700 8.7320 4.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7240 7.8110 3.3720 N 0 5 0 0 0 0 0 0 0 0 0 0 -0.5440 1.8890 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5270 1.8790 0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4930 -0.3660 0.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3820 -0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7990 -1.5820 -1.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2700 -0.1410 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4120 3.1380 -0.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9340 1.7190 0.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5550 4.7800 -3.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3630 3.7400 -3.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8120 6.1640 -4.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5480 5.2810 -3.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7890 6.9500 -1.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0690 7.4030 -2.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6510 6.0240 3.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9720 6.8640 3.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8940 7.4570 5.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6090 8.8740 4.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4650 7.1900 5.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9710 8.8330 6.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9000 8.8800 4.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2490 9.6900 4.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4730 7.2720 0.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1330 3.8220 -1.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 7 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 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 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 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 8 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 52 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 18 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 14 40 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 18 1 0 0 0 0 16 19 1 0 0 0 0 19 20 1 0 0 0 0 19 51 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 22 28 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 25 26 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 27 28 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 M CHG 1 4 -1 M CHG 1 18 -1 M CHG 1 28 -1 M END