ENAMINE-ZINC05262016 MOE2007 3D Structure written by MMmdl. 42 45 0 0 0 0 0 0 0 0999 V2000 -7.6390 5.1740 11.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7990 6.2750 11.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8500 6.3360 10.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7670 5.2560 9.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5990 4.1410 9.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5480 4.1040 10.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3990 3.1580 8.6670 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.4350 3.5090 7.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7170 5.0380 8.1650 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.9860 2.6370 6.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2420 3.2900 5.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7950 2.3740 4.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4040 1.9750 4.4010 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1280 1.2870 5.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5200 2.1930 6.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4070 2.2400 3.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0900 2.5650 3.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1320 2.8310 2.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4820 2.7750 1.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7900 2.4330 1.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5150 3.0300 0.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1020 1.8830 0.0110 F 0 0 0 0 0 0 0 0 0 0 0 0 1.5210 3.8620 0.8170 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.0570 3.5970 -0.6540 F 0 0 0 0 0 0 0 0 0 0 0 0 -8.3720 5.1430 12.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8800 7.1000 12.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1960 7.1970 10.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2040 3.2450 10.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6040 1.7280 6.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6960 4.2390 5.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3060 3.5270 5.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9320 2.9120 3.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4290 1.4800 4.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7170 0.3620 5.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0810 0.9790 5.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8530 3.0630 6.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3720 1.6590 7.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8060 2.6430 4.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8830 3.0890 3.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1550 2.3420 0.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6830 2.1860 2.1840 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.6220 1.8960 1.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 28 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 10 29 1 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 11 31 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 41 2 0 0 0 0 17 18 2 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 24 1 0 0 0 0 41 42 1 0 0 0 0 M CHG 1 41 1 M END