PUBCHEM-ZINC05601727 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 48 0 0 1 0 0 0 0 0999 V2000 1.5770 1.4510 -0.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3320 -0.0270 -0.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8640 -0.7140 0.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6560 -2.0860 0.7110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9080 -2.8090 -0.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3830 -2.1180 -1.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5840 -0.7380 -1.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0100 -0.0500 -2.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6580 -4.3040 -0.0900 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0450 -4.7680 -1.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8080 -4.6520 0.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4600 -5.5160 -0.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7980 -5.8650 -0.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4990 -5.3550 0.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8660 -4.4940 1.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5290 -4.1440 1.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3720 -4.8410 1.0390 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8730 -6.1650 0.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2720 -6.7310 2.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0210 -7.3270 3.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6620 -6.2920 4.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1410 1.6620 -1.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6270 1.9950 -0.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1580 1.8420 0.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4500 -0.1820 1.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0860 -2.5800 1.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2000 -2.6640 -2.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7770 0.4200 -3.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5370 -0.7570 -3.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7320 0.7090 -2.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9340 -5.9260 -1.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2950 -6.5320 -1.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5420 -5.6230 0.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4170 -4.0880 2.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0520 -3.4640 1.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1040 -6.7950 0.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7390 -6.1190 0.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4450 -7.8110 2.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1690 -6.2140 2.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2940 -8.3340 3.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3910 -7.3110 2.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7970 -6.9550 3.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4380 -5.5220 4.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0610 -7.2620 4.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8250 -5.9920 5.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1630 -6.4100 3.1600 N 0 3 0 0 0 0 0 0 0 0 0 0 0.8450 -5.4700 2.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 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 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 25 1 0 0 0 0 4 5 1 0 0 0 0 4 26 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 8 28 1 0 0 0 0 8 29 1 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 17 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 14 15 2 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 19 46 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 20 46 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 46 47 1 0 0 0 0 M CHG 1 46 1 M END