PUBCHEM-ZINC06514593 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 1 0 0 0 0 0999 V2000 1.2540 3.5450 -1.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4650 4.2340 -1.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6120 3.5870 -1.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5470 2.2430 -0.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3290 1.5560 -0.8270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1840 2.2090 -1.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7870 1.5870 -0.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5340 2.2180 0.4470 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9840 0.2900 -0.7310 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0520 -0.5710 -0.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9640 -1.8010 -1.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9830 -2.8510 -0.9470 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0400 -2.8370 -1.8690 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0210 -3.8320 -1.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9520 -4.8490 -0.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9070 -4.8710 0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9330 -3.8740 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9480 -3.9570 0.9540 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2670 -0.1350 0.3550 C 0 0 3 0 0 0 0 0 0 0 0 0 7.9180 -1.0040 0.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2220 1.1530 1.9620 C 0 0 3 0 0 0 0 0 0 0 0 0 8.9600 0.4770 2.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7280 1.5360 0.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6180 2.3300 0.3140 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0500 0.8100 -0.3630 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0040 2.3810 2.8470 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4570 2.0320 4.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3420 3.2140 5.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7100 4.3390 4.7650 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3610 4.0520 -2.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5150 5.2780 -1.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5520 4.1310 -1.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2440 0.5300 -0.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2340 1.6820 -1.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2610 -0.0820 -1.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0990 -2.0940 -1.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1050 -2.0560 -2.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8360 -3.8140 -2.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7140 -5.6240 -0.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8530 -5.6610 0.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5070 -3.0930 1.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9620 2.9070 2.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3320 3.0950 2.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4580 1.5890 4.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1060 1.2830 4.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9820 0.4000 1.6840 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2530 1.1180 1.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8910 2.9080 6.3410 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 30 1 0 0 0 0 2 3 2 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 34 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 10 11 2 0 0 0 0 10 19 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 15 16 2 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 25 1 0 0 0 0 19 46 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 26 1 0 0 0 0 21 46 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 26 27 1 0 0 0 0 26 42 1 0 0 0 0 26 43 1 0 0 0 0 27 28 1 0 0 0 0 27 44 1 0 0 0 0 27 45 1 0 0 0 0 28 29 2 0 0 0 0 28 48 1 0 0 0 0 46 47 1 0 0 0 0 M CHG 1 48 -1 M END