PUBCHEM-ZINC03223303 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 58 0 0 0 0 0 0 0 0999 V2000 0.9620 0.0290 0.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4290 -1.3710 0.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0880 -1.4340 0.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6150 -2.8440 0.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0570 -2.9290 0.3320 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7120 -3.2270 -0.8470 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2680 -3.4920 -2.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2450 -3.7510 -3.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6000 -3.7480 -2.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0360 -3.4810 -1.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0630 -3.2140 -0.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2290 -2.9140 0.8270 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0160 -2.7370 1.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6570 -2.2990 2.9350 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.3230 -1.8540 3.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2540 -1.4850 4.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0630 -0.3210 5.3160 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4170 -2.5840 5.7970 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.4170 -2.6030 7.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5870 -3.7250 7.8300 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.5410 -3.4820 9.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3490 -2.1590 9.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2050 -1.2070 8.1220 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.7120 -4.5720 10.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3150 -5.7680 9.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4960 -6.8330 10.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0720 -6.7190 11.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4650 -5.5430 12.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2840 -4.4760 11.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8250 -4.0590 -4.0720 S 0 0 0 0 0 0 0 0 0 0 0 0 -8.0470 -3.5060 -3.4940 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2830 -3.3010 -5.1960 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.8470 -5.6360 -4.2740 N 0 5 0 0 0 0 0 0 0 0 0 0 -7.1980 -6.0210 -3.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0490 0.0500 0.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7310 0.3530 -0.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5250 0.7510 0.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9100 -2.0730 -0.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7040 -1.6780 1.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5640 -0.7220 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3600 -1.1190 -0.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1640 -3.5610 -0.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3530 -3.1860 1.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2160 -3.4910 -2.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9460 -3.9550 -4.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0880 -3.4720 -1.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7010 -0.9930 2.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0170 -2.6900 3.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5510 -3.5020 5.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2940 -1.6990 10.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6540 -5.8770 8.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9670 -7.7500 10.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2100 -7.5470 12.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1270 -5.4560 13.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7920 -3.5810 11.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 2 38 1 0 0 0 0 2 39 1 0 0 0 0 3 4 1 0 0 0 0 3 40 1 0 0 0 0 3 41 1 0 0 0 0 4 5 1 0 0 0 0 4 42 1 0 0 0 0 4 43 1 0 0 0 0 5 6 1 0 0 0 0 5 13 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 44 1 0 0 0 0 8 9 1 0 0 0 0 8 45 1 0 0 0 0 9 10 2 0 0 0 0 9 30 1 0 0 0 0 10 11 1 0 0 0 0 10 46 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 47 1 0 0 0 0 15 48 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 49 1 0 0 0 0 19 20 2 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 50 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 51 1 0 0 0 0 26 27 1 0 0 0 0 26 52 1 0 0 0 0 27 28 2 0 0 0 0 27 53 1 0 0 0 0 28 29 1 0 0 0 0 28 54 1 0 0 0 0 29 55 1 0 0 0 0 30 31 2 0 0 0 0 30 32 2 0 0 0 0 30 33 1 0 0 0 0 33 34 1 0 0 0 0 M CHG 1 33 -1 M END