ENAMINE-ZINC05270604 MOE2007 3D Structure written by MMmdl. 47 49 0 0 0 0 0 0 0 0999 V2000 -2.0860 -3.9450 -2.9810 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2180 -2.9850 -3.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9570 -2.6150 -2.0810 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9770 -3.3680 -1.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5290 -4.6050 -1.8130 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5390 -5.0740 -0.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9590 -4.3230 0.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4170 -3.0730 0.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4160 -2.6320 -0.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7940 -1.5070 -1.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5970 -0.2410 -1.5720 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.4170 -0.8020 -0.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1040 -0.0670 -0.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0990 1.0890 0.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2940 1.8100 0.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3020 1.3540 -0.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1130 0.2110 -1.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9120 -0.5020 -1.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6290 -1.6270 -2.0160 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6270 -2.0870 -2.9190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5150 3.0200 1.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2700 -4.9900 1.2080 S 0 0 0 0 0 0 0 0 0 0 0 0 -8.8550 -3.7800 1.7770 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.1140 -5.6870 0.2430 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.5240 -5.9240 2.2550 N 0 5 0 0 0 0 0 0 0 0 0 0 -6.9680 -5.3190 2.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4670 -4.8810 -2.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5250 -4.1820 -3.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3950 -3.5150 -2.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9180 -3.4410 -3.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8300 -2.0830 -3.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1930 -5.1720 -2.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0030 -6.0390 -1.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7410 -2.4930 1.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2560 -1.8820 -0.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8620 -0.6430 0.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6850 1.4320 1.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2470 1.8880 -0.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9270 -0.0920 -2.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5370 -2.3800 -2.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2360 -2.9760 -3.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8400 -1.3370 -3.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9480 2.7230 2.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1900 3.7290 0.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5720 3.5450 1.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6610 -1.4850 -0.3500 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.7430 -0.7330 0.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 10 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 2 0 0 0 0 7 22 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 46 1 0 0 0 0 10 11 1 0 0 0 0 10 46 2 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 12 36 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 37 1 0 0 0 0 15 16 1 0 0 0 0 15 21 1 0 0 0 0 16 17 2 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 22 23 2 0 0 0 0 22 24 2 0 0 0 0 22 25 1 0 0 0 0 25 26 1 0 0 0 0 46 47 1 0 0 0 0 M CHG 1 25 -1 M CHG 1 46 1 M END