ENAMINE-ZINC06552730 MOE2007 3D Structure written by MMmdl. 40 41 0 0 1 0 0 0 0 0999 V2000 -6.1500 1.5300 0.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8490 0.7640 0.2610 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.7660 0.0070 1.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6450 1.7170 0.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4950 0.1840 -1.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7490 -0.7020 -1.2530 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.6620 -1.4530 -0.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9150 0.0980 -1.0080 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9460 -1.4140 -2.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1210 1.7980 0.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0910 0.9480 0.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0980 -0.1880 0.9130 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2860 1.6140 0.2930 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5650 1.1290 0.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7370 1.8530 0.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8790 1.0500 0.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5320 -0.2150 1.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8430 -0.4460 1.0940 S 0 0 0 0 0 0 0 0 0 0 0 0 3.7070 3.2360 -0.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6500 3.8050 -0.4060 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9090 3.8700 -0.2640 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.2940 2.2640 -0.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0050 0.8460 0.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1690 2.0520 1.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5390 2.1750 1.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7110 2.4940 -0.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5620 0.9430 -2.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5860 -0.4110 -1.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0870 -0.6950 -3.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0910 -2.0540 -2.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8480 -2.0350 -2.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2750 2.5370 0.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9880 2.2990 -0.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2860 2.5790 -0.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9120 1.3690 0.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1930 -1.0120 1.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8020 3.4490 -0.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9180 4.8280 -0.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3770 0.9380 0.0260 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.2520 0.2220 0.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 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 25 1 0 0 0 0 4 26 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 5 28 1 0 0 0 0 5 39 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 29 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 10 39 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 14 15 2 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 15 19 1 0 0 0 0 16 17 2 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 37 1 0 0 0 0 21 38 1 0 0 0 0 39 40 1 0 0 0 0 M CHG 1 39 1 M END