PUBCHEM-ZINC06426260 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 52 0 0 0 0 0 0 0 0999 V2000 0.9690 2.3980 0.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3740 0.5360 1.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5030 2.7010 1.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8860 3.5590 -0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0560 4.4750 0.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4790 5.2240 -0.8470 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8510 6.3760 -1.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8860 6.8860 -0.7150 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4570 6.9110 -2.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0630 8.0730 -3.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0280 8.3290 -4.5130 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.8850 6.8950 -4.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5120 6.2380 -3.1090 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9050 6.4270 -4.9770 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.4040 7.0120 -6.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0330 8.0570 -6.6470 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.5330 6.1790 -6.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0980 6.7990 -7.9980 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2290 5.9570 -8.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7780 6.5960 -9.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9040 5.7650 -10.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7000 1.6430 0.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1990 2.7860 1.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9480 3.2010 0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1930 0.8670 2.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4180 -0.1350 1.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3420 0.0360 1.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1640 3.2960 2.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3610 2.0930 1.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0350 4.1640 -0.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1610 2.9170 -0.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9200 3.8940 0.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7760 5.1760 1.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2740 4.9150 -1.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2780 8.7610 -2.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2990 5.5570 -4.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1460 5.1750 -6.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3250 6.0870 -5.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4670 7.8100 -7.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2960 6.9080 -8.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8600 4.9480 -8.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0360 5.8540 -7.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1420 7.6070 -9.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9680 6.7030 -10.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5670 4.7660 -10.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7590 5.6840 -9.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3880 1.7440 0.7910 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.5820 1.3950 -0.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3930 6.4320 -11.6970 N 0 3 0 0 0 0 0 0 0 0 0 0 -12.1570 5.8970 -12.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6460 6.5240 -12.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7520 7.3760 -11.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 47 1 0 0 0 0 2 25 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 2 47 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 3 47 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 5 33 1 0 0 0 0 6 7 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 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 21 49 1 0 0 0 0 47 48 1 0 0 0 0 49 50 1 0 0 0 0 49 51 1 0 0 0 0 49 52 1 0 0 0 0 M CHG 1 47 1 M CHG 1 49 1 M END