PUBCHEM-ZINC02568903 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 1 0 0 0 0 0999 V2000 0.1140 1.8830 0.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2960 0.4140 0.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8780 -0.5330 0.7720 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6890 0.0190 1.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3140 -1.3860 1.7960 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1040 -1.6380 1.8530 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4430 -2.3530 1.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6830 0.0800 1.6400 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.8500 -2.1940 3.2790 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1620 -1.5560 4.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6690 -2.0310 2.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7320 -2.2810 3.4240 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2540 -3.6090 3.4900 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5770 -4.0110 3.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5130 -3.2270 3.3140 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7710 -5.5370 3.5840 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.2100 -5.9790 2.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2480 -6.0890 4.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3070 -7.1310 4.8910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8010 -7.6380 6.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2310 -7.1150 7.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1690 -6.0840 7.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6760 -5.5740 6.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5100 -1.2720 -0.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0920 -2.4460 -0.6450 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9060 0.1640 -1.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9220 2.1220 -0.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7200 2.5600 0.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4780 2.1130 1.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5330 -4.3080 3.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 -7.5570 3.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0690 -8.4410 6.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8350 -7.5100 8.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5050 -5.6740 8.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4080 -4.7690 6.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1850 0.3860 -1.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2340 -0.8740 -1.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7750 0.8090 -1.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1900 -5.8860 3.3800 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5130 -5.3810 2.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7390 -5.4910 4.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3610 -0.5920 -1.0680 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 24 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 13 1 0 0 0 0 11 12 2 0 0 0 0 13 14 1 0 0 0 0 13 30 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 39 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 31 1 0 0 0 0 20 21 1 0 0 0 0 20 32 1 0 0 0 0 21 22 2 0 0 0 0 21 33 1 0 0 0 0 22 23 1 0 0 0 0 22 34 1 0 0 0 0 23 35 1 0 0 0 0 24 25 2 0 0 0 0 24 42 1 0 0 0 0 26 36 1 0 0 0 0 26 37 1 0 0 0 0 26 38 1 0 0 0 0 39 40 1 0 0 0 0 39 41 1 0 0 0 0 M CHG 1 42 -1 M END