PUBCHEM-ZINC02989618 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 0 0 0 0 0 0999 V2000 -2.9070 1.2680 -2.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8620 -0.2490 -2.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8050 -0.8270 -3.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7560 -2.3490 -2.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7420 -2.8050 -3.8340 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5800 -4.1530 -3.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2100 -4.9700 -3.2120 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4780 -4.5350 -4.8210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7550 -5.8950 -5.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7480 -6.3030 -5.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4850 -5.3630 -6.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2040 -4.0030 -6.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2100 -3.5910 -5.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5140 -5.7820 -7.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5060 -5.1320 -8.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1540 -6.1210 -9.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5440 -7.3430 -8.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5330 -7.1070 -7.9070 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8180 -8.6030 -9.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6850 -9.7970 -8.8190 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3420 -10.1490 -7.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -9.3390 -6.5080 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2170 -11.5280 -7.2870 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4990 -12.2980 -8.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4650 -13.9600 -8.5580 S 0 0 0 0 0 0 0 0 0 0 0 0 4.9630 -11.2500 -9.7260 S 0 0 0 0 0 0 0 0 0 0 0 0 3.7840 -12.0920 -5.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2900 -12.4620 -5.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5210 -11.7390 -6.6380 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9440 1.7050 -1.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1510 1.6030 -3.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6710 1.6600 -1.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6490 -0.5500 -1.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8490 -0.6520 -2.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0070 -0.5210 -4.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8160 -0.4190 -2.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5060 -2.6690 -1.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7230 -2.7740 -3.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2030 -6.6530 -4.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9420 -7.3690 -6.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7480 -3.2390 -6.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0230 -2.5260 -5.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7370 -4.0770 -8.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9780 -5.9660 -9.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1450 -8.5600 -10.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3910 -12.9780 -5.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9690 -11.3660 -5.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0170 -13.4500 -5.1990 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 39 1 0 0 0 0 10 11 1 0 0 0 0 10 40 1 0 0 0 0 11 12 2 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 41 1 0 0 0 0 13 42 1 0 0 0 0 14 15 2 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 15 43 1 0 0 0 0 16 17 2 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 2 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 20 26 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 27 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 27 28 1 0 0 0 0 27 46 1 0 0 0 0 27 47 1 0 0 0 0 28 29 2 0 0 0 0 28 48 1 0 0 0 0 M CHG 1 48 -1 M END