PUBCHEM-ZINC01841578 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 59 0 0 1 0 0 0 0 0999 V2000 0.2130 1.6570 -0.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4250 0.7690 0.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6520 0.1150 1.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6660 0.3420 0.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4580 1.2460 -0.9130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2280 1.8980 -1.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9530 -0.3670 0.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3320 -0.6710 1.4390 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6590 -0.6660 -0.8390 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9580 -1.3200 -0.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0830 -0.3470 -0.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6380 -1.9210 0.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0330 -2.5640 0.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5050 -2.1330 0.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5280 -1.0790 0.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2990 0.2210 0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5560 0.8850 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9690 2.1950 -0.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3300 2.5190 -0.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2740 1.5630 0.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8890 0.2580 0.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5240 -0.0520 0.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8740 -1.2400 0.6450 N 0 0 0 0 0 0 0 0 0 0 0 0 15.3430 -2.0900 0.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9270 0.7320 -0.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9120 -0.4260 -0.4150 C 0 0 3 0 0 0 0 0 0 0 0 0 11.0860 -0.9310 -1.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4620 0.1150 -0.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7420 2.1680 -0.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3620 0.5870 1.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8080 -0.5730 1.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2410 1.4790 -1.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0630 2.6030 -1.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2720 -0.4490 -1.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8820 -2.1520 -0.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1490 -1.7340 -1.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0430 0.4920 -1.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8840 0.0800 0.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9090 -2.7340 0.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4930 -1.4440 1.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1830 -3.2310 1.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1750 -3.1240 -0.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5230 -2.8230 -0.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6350 -2.6870 1.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2450 2.9500 -0.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6520 3.5280 -0.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 18.3270 1.8360 0.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 17.6270 -0.4830 0.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6200 1.3620 0.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9310 1.3670 -1.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3270 0.6900 0.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3260 0.8140 -1.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4370 -0.9470 -0.4300 N 0 0 0 0 0 0 0 0 0 0 0 0 11.1150 -1.5070 0.6730 N 0 3 0 0 0 0 0 0 0 0 0 0 11.0470 -1.0330 1.5830 H 0 0 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 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 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 32 1 0 0 0 0 6 33 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 34 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 11 53 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 12 53 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 13 54 1 0 0 0 0 14 15 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 14 54 1 0 0 0 0 15 16 2 0 0 0 0 15 23 1 0 0 0 0 16 17 1 0 0 0 0 16 25 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 20 21 2 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 21 48 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 54 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 54 55 1 0 0 0 0 M CHG 1 54 1 M END