PUBCHEM-ZINC06884340 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 46 0 0 1 0 0 0 0 0999 V2000 -1.2110 1.6300 -0.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1490 0.1030 -0.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2800 -0.3470 -0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1990 -0.4730 0.5990 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.1840 -0.0510 0.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8840 -0.1510 2.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4880 -1.1590 2.7620 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3310 -1.9330 0.4310 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9160 -2.5680 -0.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4160 -2.0010 -1.6010 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8840 -4.0700 -0.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4890 -4.7690 -1.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4410 -6.2250 -1.5340 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4930 -6.8550 -0.8850 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5080 -6.3220 -0.4550 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2270 -8.3020 -0.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0720 -9.1180 -0.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8660 -10.5510 0.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9530 -11.0150 1.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7570 -12.3860 1.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4720 -13.2960 0.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3870 -12.8400 -0.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5870 -11.4690 -0.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7380 -8.7020 -1.5200 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.4040 -7.0320 -1.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0130 -6.6010 -2.7790 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.5770 1.9890 -1.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2320 1.9690 -0.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8590 2.1110 0.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3790 -0.2740 -1.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6200 0.0460 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3540 -1.4390 -0.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9760 0.0080 -0.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9490 -2.4460 1.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8430 -4.3830 -0.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4360 -4.3400 0.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5340 -4.4610 -1.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9610 -4.4790 -2.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9930 -8.7280 0.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3880 -10.3120 1.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0450 -12.7440 1.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3160 -14.3630 0.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9430 -13.5510 -1.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3010 -11.1270 -1.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0810 1.0380 2.4640 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 4 1 0 0 0 0 2 30 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 8 1 0 0 0 0 6 7 2 0 0 0 0 6 45 1 0 0 0 0 8 9 1 0 0 0 0 8 34 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 35 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 25 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 16 24 1 0 0 0 0 17 18 1 0 0 0 0 17 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 40 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 21 22 2 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 M CHG 1 45 -1 M END