PUBCHEM-ZINC06473326 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 60 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 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 -1.3390 -0.4990 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4980 -1.8490 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3900 -2.6800 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5540 -4.0530 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8230 -4.6010 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9340 -3.7800 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7780 -2.4010 0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9010 -1.5670 0.0420 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7500 -1.7970 -1.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9220 -0.8140 -1.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8400 -0.7640 1.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6680 -1.7470 1.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8680 -0.1180 0.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7300 -0.4890 1.2720 N 0 3 0 0 0 0 0 0 0 0 0 0 -8.6480 0.0280 2.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8140 0.9810 3.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9760 1.3030 4.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9620 0.6930 5.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7960 -0.2510 4.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6480 -0.5900 3.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2990 -1.4700 2.4510 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.0410 -2.0500 2.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7040 -1.3670 1.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0960 -2.1310 0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7250 -3.3270 0.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0010 -3.8750 -1.5700 S 0 0 0 0 0 0 0 0 0 0 0 0 -10.2550 -2.4640 -2.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8690 -1.7040 -1.2150 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6030 -2.2540 -0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3120 -4.6980 -0.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9460 -5.6740 -0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9250 -4.2100 0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1630 -1.6460 -2.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1310 -2.8180 -1.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5420 0.2070 -1.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5690 -1.0010 -1.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4270 -0.9150 2.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4590 0.2570 1.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0480 -2.7670 1.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0210 -1.5590 2.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4200 -0.2290 -0.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5500 0.9180 0.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0430 1.4620 2.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3300 2.0400 4.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0780 0.9580 6.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5620 -0.7230 5.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0070 -3.8520 0.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1290 -2.2380 -3.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6890 -0.9940 0.1260 N 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 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 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 36 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 7 8 2 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 40 1 0 0 0 0 11 41 1 0 0 0 0 12 42 1 0 0 0 0 12 43 1 0 0 0 0 12 56 1 0 0 0 0 13 14 1 0 0 0 0 13 44 1 0 0 0 0 13 45 1 0 0 0 0 13 56 1 0 0 0 0 14 46 1 0 0 0 0 14 47 1 0 0 0 0 15 16 1 0 0 0 0 15 48 1 0 0 0 0 15 49 1 0 0 0 0 15 56 1 0 0 0 0 16 17 1 0 0 0 0 16 25 2 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 50 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 52 1 0 0 0 0 21 22 1 0 0 0 0 21 53 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 26 30 1 0 0 0 0 27 28 1 0 0 0 0 27 54 1 0 0 0 0 28 29 1 0 0 0 0 29 30 2 0 0 0 0 29 55 1 0 0 0 0 M CHG 1 16 1 M END