PUBCHEM-ZINC06904580 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 5.8480 3.0660 -1.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2800 5.1430 -1.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7250 5.6500 -1.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2490 5.6050 -2.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1440 4.1730 -3.0900 C 0 0 3 0 0 0 0 0 0 0 0 0 7.7510 3.5110 -2.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7430 3.7350 -3.0460 N 0 5 0 0 0 0 0 0 0 0 0 0 7.6260 4.1280 -4.4730 N 0 0 0 0 0 0 0 0 0 0 0 0 8.4560 3.1420 -4.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8030 2.2900 -4.0740 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9520 3.0960 -6.2880 C 0 0 3 0 0 0 0 0 0 0 0 0 9.1820 4.1060 -6.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8700 2.4930 -7.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3860 2.4300 -8.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6750 1.6040 -8.6630 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7050 2.2320 -7.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1640 2.2690 -6.3570 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 4.6540 5.8010 -1.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9160 5.1330 -0.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7570 6.6760 -0.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3440 5.0160 -0.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6530 6.2690 -3.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2910 5.9240 -2.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6300 1.4870 -6.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9760 3.1150 -7.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6350 1.9610 -9.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5900 3.4380 -8.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4630 0.5840 -8.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0700 1.5910 -9.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6180 1.6380 -7.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9260 3.2470 -8.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3490 4.8090 -5.1050 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