PUBCHEM-ZINC03737493 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 58 0 0 1 0 0 0 0 0999 V2000 0.5220 1.0170 -0.9390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1880 0.0690 0.0680 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0650 -0.4770 0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3530 -1.3620 1.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5980 -1.9910 1.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6000 -1.7390 0.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2850 -0.8640 -0.8710 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0340 -0.2340 -0.9470 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4050 -0.5400 -2.1480 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -4.9400 -2.4470 0.2740 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.7010 -1.9460 -0.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5110 -2.5380 1.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0800 -3.6610 2.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5170 -3.3090 3.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1470 -4.0060 4.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4570 -3.3420 5.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1440 -1.9920 5.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5180 -1.2750 4.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2160 -1.9580 3.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6170 -1.5070 2.5550 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.3050 -0.5550 2.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0660 -4.1360 6.7120 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.4100 -3.5330 7.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0610 -4.5840 8.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2820 -5.4220 9.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8840 -6.4060 10.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2690 -6.5670 10.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0520 -5.7480 9.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4520 -4.7630 8.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1620 -4.9610 1.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0140 -4.7410 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5390 1.3700 -0.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5170 0.5550 -1.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1450 1.8840 -0.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5990 -1.5640 1.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7710 -2.6750 1.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8370 0.4370 -1.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3950 -5.0580 4.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3730 -1.4510 6.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2800 -0.2240 5.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5140 -3.1520 8.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1100 -2.7020 7.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2000 -5.3150 9.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2720 -7.0490 11.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7370 -7.3340 11.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.1310 -5.8780 9.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0760 -4.1390 8.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3600 -5.6180 1.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1150 -5.4600 1.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8340 -5.6850 -0.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8930 -4.2520 -0.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8330 -3.8470 -0.3030 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.6980 -3.7670 -1.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9790 -4.2840 0.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 37 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 52 1 0 0 0 0 12 13 2 0 0 0 0 12 20 1 0 0 0 0 13 14 1 0 0 0 0 13 30 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 22 1 0 0 0 0 17 18 2 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 43 1 0 0 0 0 26 27 1 0 0 0 0 26 44 1 0 0 0 0 27 28 2 0 0 0 0 27 45 1 0 0 0 0 28 29 1 0 0 0 0 28 46 1 0 0 0 0 29 47 1 0 0 0 0 30 31 1 0 0 0 0 30 48 1 0 0 0 0 30 49 1 0 0 0 0 31 50 1 0 0 0 0 31 51 1 0 0 0 0 31 52 1 0 0 0 0 52 53 1 0 0 0 0 52 54 1 0 0 0 0 M CHG 1 52 1 M END