PUBCHEM-ZINC06228748 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 0 0 1 0 0 0 0 0999 V2000 0.3310 1.3430 0.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3580 -0.0750 0.2240 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5680 -0.4800 -1.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7170 0.2700 -2.0240 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5250 -2.0130 -1.1510 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0700 -2.3950 -0.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8960 -2.5400 -1.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2670 -3.5640 -0.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5720 -4.0610 -0.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5210 -3.5460 -1.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1650 -2.5360 -2.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8610 -2.0370 -2.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2430 -2.4720 -2.3410 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6170 -2.5750 -2.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3240 -2.3060 -1.3930 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1830 -3.0550 -3.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6860 -2.7630 -3.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2970 -3.3030 -5.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5560 -5.0970 -5.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9200 -4.5530 -3.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7690 -5.4050 -6.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7970 -6.9120 -6.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2470 -7.6030 -7.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2750 -8.9990 -7.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8510 -9.7260 -6.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4030 -9.0590 -5.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3790 -7.6620 -5.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0710 -6.8930 -3.9200 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.2900 1.7830 0.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4890 1.7850 -0.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1630 1.5480 1.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 -3.9810 0.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8500 -4.8490 0.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5380 -3.9310 -1.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9050 -2.1340 -2.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6120 -1.2440 -2.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7020 -2.6990 -3.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6740 -2.5000 -4.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8570 -1.6810 -3.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2090 -3.2030 -2.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8690 -2.8300 -5.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3820 -3.1590 -5.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4360 -6.1840 -5.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1180 -4.6450 -6.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3060 -5.1070 -3.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8410 -4.7480 -3.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8000 -5.0330 -6.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2980 -5.0050 -7.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7940 -7.0630 -8.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8490 -9.5210 -8.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8720 -10.8120 -6.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8510 -9.6350 -4.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0330 -4.7860 -5.1590 N 0 3 0 0 0 0 0 0 0 0 0 0 5.4430 -5.2180 -4.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 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 5 7 1 0 0 0 0 5 13 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 10 11 2 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 20 1 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 18 53 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 19 53 1 0 0 0 0 20 45 1 0 0 0 0 20 46 1 0 0 0 0 21 22 1 0 0 0 0 21 47 1 0 0 0 0 21 48 1 0 0 0 0 21 53 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 25 26 2 0 0 0 0 25 51 1 0 0 0 0 26 27 1 0 0 0 0 26 52 1 0 0 0 0 27 28 1 0 0 0 0 53 54 1 0 0 0 0 M CHG 1 53 1 M END