PUBCHEM-ZINC05996175 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 48 0 0 1 0 0 0 0 0999 V2000 1.3640 -0.9080 -2.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7790 -1.5630 -1.4000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5590 -1.8500 -1.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4110 -1.5900 -2.1360 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7970 -2.4840 -0.0810 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1350 -2.8720 0.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0280 -1.9200 0.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3470 -2.2870 0.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7710 -3.5990 0.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8590 -4.5820 0.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5140 -4.2130 -0.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6060 -5.1960 -0.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0110 -6.5140 -0.7750 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3300 -6.8780 -0.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2420 -5.9230 -0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0530 -4.0180 0.8850 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.1040 -3.0970 0.5360 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.8310 -2.5530 -0.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3760 -3.9320 0.2740 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.5660 -4.6010 1.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5790 -3.0180 0.0450 C 0 0 3 0 0 0 0 0 0 0 0 0 -9.4950 -2.5090 -0.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7110 -2.0050 1.1740 C 0 0 3 0 0 0 0 0 0 0 0 0 -9.9620 -2.5300 2.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3950 -1.2420 1.3100 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.1490 -0.6910 0.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3440 -2.1770 1.6110 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.5570 -0.1770 2.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5100 0.2150 3.0050 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.8080 -1.1330 0.8760 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.7000 -0.4100 1.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7680 -3.8150 -0.0400 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.5000 -3.1710 0.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2300 -4.7740 -0.8790 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.1290 -5.1210 -1.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 0.0340 -2.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1530 -1.5530 -2.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6210 -0.7130 -3.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3660 -1.8320 -0.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7020 -0.9030 0.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0230 -1.5420 1.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5670 -4.9380 -0.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2960 -7.2530 -1.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6520 -7.9020 -0.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2710 -6.2320 0.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7610 0.2250 2.5670 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 39 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 40 1 0 0 0 0 8 9 2 0 0 0 0 8 41 1 0 0 0 0 9 10 1 0 0 0 0 9 16 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 12 13 1 0 0 0 0 12 42 1 0 0 0 0 13 14 2 0 0 0 0 13 43 1 0 0 0 0 14 15 1 0 0 0 0 14 44 1 0 0 0 0 15 45 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 27 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 34 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 32 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 30 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 28 1 0 0 0 0 28 29 2 0 0 0 0 28 46 1 0 0 0 0 30 31 1 0 0 0 0 32 33 1 0 0 0 0 34 35 1 0 0 0 0 M CHG 1 46 -1 M END