PUBCHEM-ZINC05734047 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 49 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 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7630 -2.0410 1.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5030 -2.5480 2.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5240 -4.0770 2.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2320 -4.5630 3.6510 N 0 3 0 0 0 0 0 0 0 0 0 0 1.6610 -4.8400 4.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6680 -5.2720 5.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8260 -5.2420 4.9840 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7070 -5.4880 5.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5170 -4.8050 3.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6690 -4.5960 2.4070 S 0 0 0 0 0 0 0 0 0 0 0 0 6.1920 -5.1120 3.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3650 -5.0120 2.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6530 -5.4480 2.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7480 -5.3540 2.0500 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3500 -5.6200 6.9980 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0820 -5.5460 7.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8410 -5.8620 8.5880 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0730 -5.1340 6.6530 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8270 -5.0960 7.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2950 -4.7720 5.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6220 -4.4000 4.6620 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4060 -6.0770 7.9040 C 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 -1.0200 -0.3810 0.0100 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 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2600 -2.4180 1.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2730 -2.3920 0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5250 -2.1700 2.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9930 -2.1960 3.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5010 -4.4550 2.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0340 -4.4290 1.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3770 -4.4640 4.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0900 -6.1430 3.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1810 -5.6600 1.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4680 -3.9810 1.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8370 -4.7990 3.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5500 -6.4780 3.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5990 -5.6160 2.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8300 -5.2210 8.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9870 -6.7760 8.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1880 -6.5740 7.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 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 6 38 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 23 1 0 0 0 0 9 10 1 0 0 0 0 9 18 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 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 43 1 0 0 0 0 16 44 1 0 0 0 0 17 45 1 0 0 0 0 18 19 1 0 0 0 0 18 25 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 23 24 2 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 M CHG 1 7 1 M END