IBS-ZINC00629651 MOE2007 3D Structure written by MMmdl. 54 57 0 0 1 0 0 0 0 0999 V2000 -6.4180 6.0330 -1.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7660 4.8620 -1.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0890 3.5720 -1.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4910 2.4980 -0.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5700 2.7140 0.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2500 4.0050 0.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8450 5.0790 -0.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8080 1.3450 0.9610 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.6860 0.2400 0.8000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3910 1.8070 2.2380 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4310 0.9840 0.1150 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3290 1.9470 0.0630 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3730 2.5970 0.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4490 2.7920 -1.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0150 1.2080 0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0020 0.0000 0.0850 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1390 1.8910 0.0010 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2870 1.1710 0.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7440 0.4580 -1.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8960 -0.2700 -0.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6180 -0.3000 0.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1660 0.4150 1.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9950 1.1550 1.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8650 0.3850 2.5310 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9980 -0.3050 2.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5470 -1.0390 1.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8660 -1.0760 0.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3120 -1.7180 -0.5590 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8080 -1.7890 1.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8900 -3.1360 1.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0670 -3.8280 1.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1630 -3.1890 2.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0850 -1.8530 2.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9140 -1.1510 2.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6390 -4.0670 2.5560 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -7.3320 6.3030 -1.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7340 6.8820 -1.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6580 5.7610 -2.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8090 3.4020 -2.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7440 1.4890 -1.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5340 4.1740 1.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5920 6.0870 0.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3540 0.1340 -0.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6290 3.5090 -1.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4050 2.1420 -2.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3990 3.3260 -1.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1840 0.4830 -1.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2480 -0.8210 -1.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6350 1.7140 2.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4970 -0.2770 3.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0340 -3.6360 1.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1330 -4.8700 1.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9430 -1.3600 3.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8550 -0.1080 2.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 39 1 0 0 0 0 4 5 1 0 0 0 0 4 40 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 41 1 0 0 0 0 7 42 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 43 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 14 44 1 0 0 0 0 14 45 1 0 0 0 0 14 46 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 47 1 0 0 0 0 20 21 1 0 0 0 0 20 48 1 0 0 0 0 21 22 2 0 0 0 0 21 27 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 26 29 1 0 0 0 0 27 28 2 0 0 0 0 29 30 1 0 0 0 0 29 34 2 0 0 0 0 30 31 2 0 0 0 0 30 51 1 0 0 0 0 31 32 1 0 0 0 0 31 52 1 0 0 0 0 32 33 2 0 0 0 0 32 35 1 0 0 0 0 33 34 1 0 0 0 0 33 53 1 0 0 0 0 34 54 1 0 0 0 0 M END