PUBCHEM-ZINC05857311 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 44 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0200 -0.6140 1.0450 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.6690 -1.1640 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 -2.1190 -1.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 -2.6960 -2.5130 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8460 -2.2760 -3.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1620 -4.2190 -2.4450 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1210 -4.4720 -1.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0950 -4.7940 -3.8630 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1420 -5.8820 -3.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2240 -4.3660 -4.5140 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.0600 -4.7860 -3.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3170 -2.8380 -4.5020 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.2720 -2.5290 -4.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2170 -2.3660 -3.1570 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2340 -2.2810 -5.2930 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2310 -0.9500 -5.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1040 -0.2740 -4.9820 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8620 -0.3000 -6.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2670 -4.8510 -5.9000 N 0 5 0 0 0 0 0 0 0 0 0 0 -2.1280 -4.5800 -6.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2100 -4.2920 -4.6440 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6800 -5.0870 -5.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1750 -6.1680 -5.8110 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8360 -4.6330 -6.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9140 -4.7740 -1.6430 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6900 -4.8980 -0.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3690 -4.5540 0.1430 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7600 -5.4670 0.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9200 -2.4460 -0.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8600 -2.4700 -0.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8510 -0.7010 -7.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6980 0.7770 -6.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8280 -0.5060 -5.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1560 -3.6410 -6.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6650 -5.3330 -6.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5260 -4.5950 -7.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6380 -5.7180 -0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3850 -6.3650 1.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0330 -4.7290 1.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 16 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 27 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 23 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 21 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 36 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 39 1 0 0 0 0 26 40 1 0 0 0 0 26 41 1 0 0 0 0 27 28 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 30 42 1 0 0 0 0 30 43 1 0 0 0 0 30 44 1 0 0 0 0 M CHG 1 21 -1 M END