PUBCHEM-ZINC02864928 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 51 0 0 0 0 0 0 0 0999 V2000 -0.0680 1.2770 -0.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0060 -0.2190 -0.8150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0810 -0.9880 0.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0700 -2.3820 0.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0020 -3.0270 -0.9190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1100 -2.2970 -2.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1310 -0.8950 -2.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3360 -0.0190 -3.5880 S 0 0 0 0 0 0 0 0 0 0 0 0 0.4400 -0.9930 -4.6590 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6730 1.0200 -3.6480 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8400 0.7410 -3.4170 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9810 0.0040 -2.9670 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3830 -1.1850 -3.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4970 -1.8720 -3.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2170 -1.3660 -2.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8400 -0.1620 -1.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7150 0.5170 -1.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6230 0.3980 -0.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1830 1.4690 0.3020 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.1080 -4.7970 -0.9770 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.2560 -5.2020 -2.3620 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9730 -5.3140 -0.1630 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5560 -5.1310 -0.1600 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7530 -4.4270 -0.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2360 -4.3930 -1.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3880 -3.6640 -2.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0600 -2.9730 -1.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5970 -3.0080 0.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4390 -3.7510 0.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3250 -2.2670 1.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8340 -2.3460 2.4960 O 0 5 0 0 0 0 0 0 0 0 0 0 0.8000 1.7610 -1.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9870 1.6540 -1.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0840 1.5850 0.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1690 -0.5010 1.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1420 -2.9460 1.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1780 -2.8150 -3.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7940 1.7280 -3.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8490 -1.5840 -4.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8090 -2.8010 -3.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0870 -1.9090 -1.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4150 1.4500 -1.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4370 -5.3830 0.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7340 -4.9350 -2.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7670 -3.6350 -3.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9570 -2.4050 -1.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0710 -3.7780 1.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6670 -0.2330 0.1350 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3770 -1.6300 1.0030 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 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 5 6 2 0 0 0 0 5 20 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 15 16 2 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 48 2 0 0 0 0 20 21 2 0 0 0 0 20 22 2 0 0 0 0 20 23 1 0 0 0 0 23 24 1 0 0 0 0 23 43 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 44 1 0 0 0 0 26 27 1 0 0 0 0 26 45 1 0 0 0 0 27 28 2 0 0 0 0 27 46 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 29 47 1 0 0 0 0 30 31 1 0 0 0 0 30 49 2 0 0 0 0 M CHG 1 19 -1 M CHG 1 31 -1 M END