IBS-ZINC06672324 MOE2007 3D Structure written by MMmdl. 58 60 0 0 1 0 0 0 0 0999 V2000 -3.8880 7.5070 8.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5520 7.2390 7.1430 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0030 7.3820 7.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8280 6.8640 6.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4290 6.7200 6.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6910 6.3500 4.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3310 6.1130 3.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7210 6.2370 3.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4460 6.6080 4.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5500 5.6960 2.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6170 3.7300 1.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5550 2.2040 1.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2000 1.6150 0.0410 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.3200 1.9830 -0.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1100 0.0690 0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5270 -0.5650 -1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8280 -1.0830 -1.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2660 -1.6550 -2.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4120 -1.7200 -3.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1180 -1.2110 -3.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3240 -0.6370 -2.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9420 -0.0300 -2.3320 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.6430 2.1010 -0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5400 1.8850 1.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8540 2.3510 0.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2830 3.0330 -0.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4120 3.2480 -1.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0970 2.7830 -1.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9000 3.6140 -0.2570 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -3.1790 8.3360 8.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6000 7.7910 9.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3600 6.6170 8.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4800 6.4340 6.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4180 7.6780 8.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2960 8.1560 6.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8680 6.8980 6.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6090 6.2630 4.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2660 6.0600 2.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5240 6.6960 4.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5400 6.1200 2.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0440 6.0310 1.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3730 4.1880 1.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1240 4.0870 0.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5790 1.8090 1.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0940 1.8760 2.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7140 -0.3470 0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9150 -0.2490 0.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5180 -1.0400 -0.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2770 -2.0480 -2.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7530 -2.1670 -4.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5420 -1.2660 -4.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2300 1.3440 1.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5350 2.1770 1.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7460 3.7730 -2.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4330 2.9520 -2.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4110 4.2100 2.3890 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.3520 3.7960 2.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9790 3.8770 3.2610 H 0 0 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 3 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 9 39 1 0 0 0 0 10 40 1 0 0 0 0 10 41 1 0 0 0 0 10 56 1 0 0 0 0 11 12 1 0 0 0 0 11 42 1 0 0 0 0 11 43 1 0 0 0 0 11 56 1 0 0 0 0 12 13 1 0 0 0 0 12 44 1 0 0 0 0 12 45 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 23 1 0 0 0 0 15 16 1 0 0 0 0 15 46 1 0 0 0 0 15 47 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 48 1 0 0 0 0 18 19 1 0 0 0 0 18 49 1 0 0 0 0 19 20 2 0 0 0 0 19 50 1 0 0 0 0 20 21 1 0 0 0 0 20 51 1 0 0 0 0 21 22 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 52 1 0 0 0 0 25 26 1 0 0 0 0 25 53 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 54 1 0 0 0 0 28 55 1 0 0 0 0 56 57 1 0 0 0 0 56 58 1 0 0 0 0 M CHG 1 56 1 M END