IBS-ZINC06760759 MOE2007 3D Structure written by MMmdl. 53 56 0 0 1 0 0 0 0 0999 V2000 8.9440 3.2930 4.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3760 4.0090 3.5650 C 0 0 3 0 0 0 0 0 0 0 0 0 7.3130 4.2020 3.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5650 3.1290 2.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8140 5.1190 0.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6220 5.9800 2.2260 C 0 0 3 0 0 0 0 0 0 0 0 0 7.5670 6.2290 2.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0630 5.2480 3.3730 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4400 7.2650 2.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1990 3.0200 -0.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0820 1.9740 -0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8170 2.6300 -0.1800 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7130 1.8400 -0.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8520 0.4560 -0.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7510 -0.3500 -0.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4800 0.2160 -0.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3280 1.6110 -0.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4590 2.4160 -0.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1000 2.1560 -0.4260 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0240 1.4340 -0.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0220 0.0780 -0.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2680 -0.6230 -0.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3300 -1.8380 -0.1800 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2960 -0.6820 -0.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4490 -1.7540 -1.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6340 -2.4620 -1.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6730 -2.1010 -0.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5270 -1.0330 0.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3440 -0.3230 0.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1630 -2.9900 -0.4920 Cl 0 0 0 0 0 0 0 0 0 0 0 0 10.0060 3.1020 4.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8080 3.9200 5.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4210 2.3480 4.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9960 2.2070 2.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6220 2.8920 2.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8750 4.9140 0.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4270 5.6500 0.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4950 7.0150 1.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1040 7.8220 1.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3050 7.8750 2.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1660 2.5170 -0.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1110 3.6480 -0.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1150 1.4040 0.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2170 1.3000 -0.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8370 0.0200 -0.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8620 -1.4220 -0.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3600 3.4900 -0.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9690 1.9480 -0.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6410 -2.0340 -1.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7530 -3.2950 -1.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3400 -0.7560 1.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2320 0.5100 1.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0610 3.8590 1.1450 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 8 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 4 53 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 5 37 1 0 0 0 0 5 53 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 9 38 1 0 0 0 0 9 39 1 0 0 0 0 9 40 1 0 0 0 0 10 11 1 0 0 0 0 10 41 1 0 0 0 0 10 42 1 0 0 0 0 10 53 1 0 0 0 0 11 12 1 0 0 0 0 11 43 1 0 0 0 0 11 44 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 45 1 0 0 0 0 15 16 1 0 0 0 0 15 46 1 0 0 0 0 16 17 2 0 0 0 0 16 22 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 47 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 48 1 0 0 0 0 21 22 1 0 0 0 0 21 24 1 0 0 0 0 22 23 2 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 49 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 27 28 2 0 0 0 0 27 30 1 0 0 0 0 28 29 1 0 0 0 0 28 51 1 0 0 0 0 29 52 1 0 0 0 0 M END