PUBCHEM-ZINC00956733 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 56 0 0 1 0 0 0 0 0999 V2000 0.7030 1.5960 0.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4600 0.1110 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3150 -0.6060 1.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0720 -2.0960 1.0060 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8670 -2.6150 1.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0130 -2.6430 -0.3600 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1770 -1.7980 -1.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1110 -2.4200 -2.9900 S 0 0 0 0 0 0 0 0 0 0 0 0 0.3840 -0.4870 -1.2220 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2310 -2.4160 1.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1380 -1.4090 1.9590 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3340 -1.7020 2.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6260 -3.0050 2.9490 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7230 -4.0160 2.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5240 -3.7240 2.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6360 -4.7180 1.7810 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9500 -6.0200 2.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1950 -6.9570 1.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1610 -7.1810 2.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2110 -8.0400 2.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2960 -8.6760 1.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3300 -8.4520 0.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2760 -7.5960 0.7710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3890 0.0140 2.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5150 1.2220 2.4920 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3190 -0.7340 3.5290 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2640 -0.1170 4.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1000 1.2220 4.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1500 1.8220 6.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1660 1.0590 7.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5200 -0.2650 7.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5540 -0.8120 5.8650 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7660 1.7810 0.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3840 2.0710 -0.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1360 2.0090 0.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1390 -3.5890 -0.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4900 0.0690 -2.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9120 -0.3910 1.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0410 -0.9130 2.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5610 -3.2320 3.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9510 -5.0320 2.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1170 -5.9660 3.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8520 -6.3890 1.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0950 -6.6850 3.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9660 -8.2150 3.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1170 -9.3470 1.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3960 -8.9480 -0.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4800 -7.4240 0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3060 -1.7020 3.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3400 1.7860 3.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4300 2.8600 6.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1370 1.4980 8.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7670 -0.8620 7.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 2 0 0 0 0 2 9 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 10 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 13 14 2 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 17 43 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 44 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 21 22 2 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 23 48 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 49 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 50 1 0 0 0 0 29 30 1 0 0 0 0 29 51 1 0 0 0 0 30 31 2 0 0 0 0 30 52 1 0 0 0 0 31 32 1 0 0 0 0 31 53 1 0 0 0 0 M END