PUBCHEM-ZINC06910074 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 54 0 0 1 0 0 0 0 0999 V2000 -0.0540 -0.0150 -2.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1830 0.2480 -1.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 1.7420 -1.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4990 -0.3060 -0.7130 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5750 -0.0210 0.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5210 -1.8440 -0.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2170 -2.4410 -1.6120 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6740 -2.4620 0.0960 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4500 -3.9190 0.1920 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4470 -4.3790 0.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3470 -4.4340 -1.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7940 -3.9320 -1.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3170 -5.9600 -1.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2390 -4.2510 1.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7330 -3.2330 2.1360 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7000 0.1630 -1.4030 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3880 1.3080 -1.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0280 2.0360 -0.1460 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5590 1.5890 -1.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2200 0.7670 -2.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3180 1.4750 -3.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3110 1.1400 -4.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2790 2.0900 -4.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2770 3.3520 -4.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3010 3.7000 -3.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3240 2.7440 -2.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2530 2.7930 -1.9000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8930 3.9470 -1.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4960 1.6910 -5.7880 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.9110 0.3460 -3.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1090 -1.0850 -3.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8390 0.4940 -3.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6560 -0.2650 -0.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7290 2.3490 -1.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1080 1.9570 0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9960 2.0710 -1.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1340 -1.9460 0.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1360 -4.0470 -1.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3750 -4.3270 -0.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2940 -4.2470 -1.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8360 -2.8390 -1.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9020 -6.4450 -0.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7100 -6.3360 -1.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7400 -6.2760 -2.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0200 -0.4290 -2.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9610 -0.2570 -3.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3170 0.1550 -4.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0380 4.0810 -4.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3130 4.6880 -2.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8450 4.1920 -1.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5050 4.8090 -1.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0600 3.7010 -0.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2060 -5.4580 1.9190 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 16 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 14 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 38 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 13 42 1 0 0 0 0 13 43 1 0 0 0 0 13 44 1 0 0 0 0 14 15 2 0 0 0 0 14 53 1 0 0 0 0 16 17 1 0 0 0 0 16 45 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 2 0 0 0 0 19 27 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 23 29 1 0 0 0 0 24 25 2 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 28 50 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 M CHG 1 53 -1 M END