PUBCHEM-ZINC05759645 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 49 0 0 1 0 0 0 0 0999 V2000 2.0860 -0.1870 0.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9720 -1.2340 0.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8210 -1.9480 1.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3380 -0.5560 -0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5110 -1.5060 -0.3330 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.7070 -2.1950 0.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7450 -0.5690 -0.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0550 -0.3520 -1.7270 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2740 -2.2890 -1.5560 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6340 -1.8280 -2.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6780 -3.5230 -1.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2940 -4.1520 -0.6180 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5430 -4.1030 -3.0200 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.1740 -3.3280 -3.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8830 -4.6430 -3.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4650 -5.1560 -2.9320 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1320 -5.6710 -4.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8830 -5.3350 -5.1810 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1950 -6.7320 -3.6550 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6630 -7.5120 -3.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2940 -6.1510 -2.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3320 -7.1960 -2.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4810 -6.4830 -1.1180 S 0 0 0 0 0 0 0 0 0 0 0 0 6.5800 -7.9050 -0.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6850 -7.4070 -4.8570 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3120 -8.3240 -5.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5900 -6.8640 -5.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1540 -5.7840 -5.6410 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0340 -0.6540 0.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2420 0.3090 -0.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8460 0.5810 1.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2830 -1.9660 -0.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0990 -2.7660 1.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7770 -2.3790 2.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4890 -1.2550 2.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6360 0.1620 0.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1300 0.0420 -0.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6330 -3.8470 -3.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7960 -5.0900 -4.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2640 -5.4140 -2.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6590 -5.4890 -1.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7830 -5.3000 -3.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8250 -5.7420 -1.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8390 -8.0640 -1.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9080 -7.5300 -3.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3590 -7.6590 -0.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0210 -8.7690 -0.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0590 -8.1550 -1.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7790 -7.5450 -6.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2830 -0.1550 0.5510 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 32 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 2 0 0 0 0 7 50 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 16 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 25 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 23 24 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 27 28 2 0 0 0 0 27 49 1 0 0 0 0 M CHG 1 50 -1 M END