PUBCHEM-ZINC01165683 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 53 0 0 0 0 0 0 0 0999 V2000 -1.5470 1.0160 0.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7240 -0.2360 0.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -0.6990 1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7960 -1.8480 1.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7910 -2.5370 -0.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -2.0760 -1.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7390 -0.9240 -1.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -2.7710 -2.4190 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1380 -4.1140 -2.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1560 -4.7270 -1.3810 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2490 -4.8520 -3.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3690 -6.2890 -3.4770 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7070 -7.0560 -3.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8330 -6.6240 -3.5290 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4200 -8.4910 -3.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3440 -9.5380 -2.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8990 -10.8270 -2.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7380 -12.0210 -2.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8880 -13.0570 -2.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4290 -12.5410 -2.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3880 -11.2200 -2.6140 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6460 -13.3250 -2.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5660 -14.7090 -1.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7080 -15.4340 -1.7470 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9480 -14.8140 -1.7930 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0440 -13.4510 -2.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9060 -12.7010 -2.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3740 -12.8010 -2.0750 N 0 3 0 0 0 0 0 0 0 0 0 0 6.4630 -13.5180 -1.8930 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4670 -11.5070 -2.2990 O 0 5 0 0 0 0 0 0 0 0 0 0 1.2970 -8.5840 -3.0260 S 0 0 0 0 0 0 0 0 0 0 0 0 1.5690 -6.8590 -3.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6450 -6.2980 -3.3720 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9510 1.8820 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4300 0.9540 -0.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8550 1.1190 1.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 -0.1620 2.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3920 -2.2060 1.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3820 -3.4340 -0.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3390 -0.5650 -1.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0750 -2.2880 -3.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6410 -4.6640 -4.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1310 -4.5050 -4.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4020 -9.3400 -3.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8160 -12.0670 -2.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1670 -14.0870 -2.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6030 -15.1970 -1.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6450 -16.4960 -1.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8440 -15.3970 -1.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9800 -11.6400 -2.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 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 37 1 0 0 0 0 4 5 1 0 0 0 0 4 38 1 0 0 0 0 5 6 2 0 0 0 0 5 39 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 40 1 0 0 0 0 8 9 1 0 0 0 0 8 41 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 42 1 0 0 0 0 11 43 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 15 31 1 0 0 0 0 16 17 1 0 0 0 0 16 44 1 0 0 0 0 17 18 2 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 19 20 2 0 0 0 0 19 46 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 24 48 1 0 0 0 0 25 26 2 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 27 50 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 31 32 1 0 0 0 0 32 33 2 0 0 0 0 M CHG 1 28 1 M CHG 1 30 -1 M END