PUBCHEM-ZINC02991951 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 56 0 0 0 0 0 0 0 0999 V2000 -0.8840 -0.1730 -1.8930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6110 -1.6700 -2.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0900 -2.2390 -0.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9060 -2.3860 -2.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6320 -1.9200 -3.3530 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0700 -1.0130 -2.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2240 -1.1290 -3.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3860 -0.3960 -3.2090 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5270 -0.3590 -3.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5920 -0.9320 -4.9920 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7220 0.3950 -3.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8270 0.2840 -4.3560 N 0 0 0 0 0 0 0 0 0 0 0 0 7.9100 1.1690 -5.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9040 0.6830 -6.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9860 1.5600 -7.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0750 2.9210 -7.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0810 3.4080 -6.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9930 2.5360 -5.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1760 4.8650 -6.0340 N 0 3 0 0 0 0 0 0 0 0 0 0 8.2490 5.6350 -6.9750 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1820 5.2950 -4.8940 O 0 5 0 0 0 0 0 0 0 0 0 0 8.9780 -0.8900 -4.1580 S 0 0 0 0 0 0 0 0 0 0 0 0 10.0920 -0.4970 -4.9480 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0630 -1.1360 -2.7620 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3470 -2.3660 -4.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5930 -2.6390 -6.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0980 -3.7960 -6.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3590 -4.6820 -6.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1140 -4.4090 -4.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6120 -3.2540 -4.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 0.3370 -1.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2550 0.2320 -2.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6310 -0.0230 -1.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8360 -2.0880 0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1050 -3.3050 -0.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8330 -1.7290 -0.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2770 -1.9800 -3.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7110 -3.4520 -2.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6520 -2.2350 -1.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8080 0.0370 -2.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3740 -1.4350 -1.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4860 -2.1780 -3.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9200 -0.7070 -4.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3340 0.0630 -2.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4600 1.4450 -3.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0260 -0.0270 -2.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8350 -0.3800 -6.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9820 1.1830 -8.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1390 3.6050 -8.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9940 2.9180 -4.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1700 -1.9470 -6.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2890 -4.0090 -7.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9720 -5.5860 -6.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5360 -5.1010 -4.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4240 -3.0430 -3.0800 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 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 40 1 0 0 0 0 6 41 1 0 0 0 0 7 8 1 0 0 0 0 7 42 1 0 0 0 0 7 43 1 0 0 0 0 8 9 1 0 0 0 0 8 44 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 45 1 0 0 0 0 11 46 1 0 0 0 0 12 13 1 0 0 0 0 12 22 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 47 1 0 0 0 0 15 16 1 0 0 0 0 15 48 1 0 0 0 0 16 17 2 0 0 0 0 16 49 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 50 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 22 23 2 0 0 0 0 22 24 2 0 0 0 0 22 25 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 27 52 1 0 0 0 0 28 29 2 0 0 0 0 28 53 1 0 0 0 0 29 30 1 0 0 0 0 29 54 1 0 0 0 0 30 55 1 0 0 0 0 M CHG 1 19 1 M CHG 1 21 -1 M END