ENAMINE-ZINC06638296 MOE2007 3D Structure written by MMmdl. 57 59 0 0 1 0 0 0 0 0999 V2000 -0.0590 7.5170 0.8090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0060 7.1530 -0.2150 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2360 6.0820 -0.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6060 7.4410 -1.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4060 8.0780 -2.3650 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5900 6.8810 -2.0810 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1820 6.9770 -3.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6320 7.6990 -4.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2750 7.7420 -5.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4760 7.0650 -5.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0310 6.3450 -4.8050 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3930 6.2980 -3.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2930 5.6270 -4.9980 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.7950 5.6390 -6.1300 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7830 5.0490 -4.0180 O 0 5 0 0 0 0 0 0 0 0 0 0 3.2500 7.1460 1.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6350 7.8150 1.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6010 10.0310 0.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2140 9.3660 0.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8740 9.9800 1.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7000 9.4780 2.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8570 8.8170 2.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6740 8.3350 3.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1080 7.7680 4.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9230 7.2920 5.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3100 7.3690 5.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8840 7.9160 4.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0700 8.3910 3.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4360 8.5340 0.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9210 6.8460 0.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3170 7.4300 1.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1200 6.3320 -1.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3010 8.2450 -4.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8340 8.3080 -6.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9570 7.1120 -6.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8370 5.7320 -2.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7550 7.1410 2.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3490 6.1200 0.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1590 7.7480 0.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2320 7.3340 1.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0890 10.0140 -0.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5140 11.0640 0.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5880 9.8420 -0.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7250 9.4260 1.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3650 9.8450 0.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6830 11.0490 1.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3350 9.7080 3.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2610 8.6230 1.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0310 7.6790 4.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4760 6.8550 6.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9430 6.9990 6.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9660 7.9720 4.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5410 8.8130 2.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3450 7.8910 0.0770 N 0 3 0 0 0 0 0 0 0 0 0 0 2.7850 7.8810 -0.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5170 9.2960 1.4640 N 0 3 0 0 0 0 0 0 0 0 0 0 4.1090 9.3760 2.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 54 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 10 11 2 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 36 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 16 54 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 17 56 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 18 56 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 19 54 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 20 46 1 0 0 0 0 20 56 1 0 0 0 0 21 22 2 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 22 48 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 49 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 26 27 2 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 27 52 1 0 0 0 0 28 53 1 0 0 0 0 54 55 1 0 0 0 0 56 57 1 0 0 0 0 M CHG 1 13 1 M CHG 1 15 -1 M CHG 1 54 1 M CHG 1 56 1 M END