CHEMBRIDGE-ZINC04115049 MOE2007 3D Structure written by MMmdl. 40 42 0 0 0 0 0 0 0 0999 V2000 4.1930 1.6950 3.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 2.6400 4.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3100 4.0290 3.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2920 4.9710 3.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2640 6.2650 3.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2660 6.6320 2.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2880 5.7080 2.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2840 4.4140 2.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3220 3.4410 2.2970 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0530 3.8400 2.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8420 5.0140 2.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8200 5.9860 2.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0590 5.7080 1.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2860 4.5150 0.8830 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2870 3.5430 0.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0600 3.8280 1.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8610 3.1090 1.3840 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6270 1.7990 0.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 1.9370 -0.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2430 0.7000 3.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7300 1.5950 2.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2180 2.0530 3.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8800 2.6900 5.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4000 2.2390 4.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0920 4.6970 4.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0320 6.9810 3.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2650 7.6320 2.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5680 6.0100 1.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5510 2.4560 2.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6310 6.8980 2.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8680 6.4320 1.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2670 4.3450 0.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4620 2.6270 0.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5770 1.2610 0.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0120 1.2100 1.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1830 0.9530 -1.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9780 2.4530 -0.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6250 2.5170 -1.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5420 4.9600 2.4570 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.1090 5.6500 3.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 3 1 0 0 0 0 2 23 1 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 5 26 1 0 0 0 0 6 7 2 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 28 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 29 1 0 0 0 0 10 17 1 0 0 0 0 10 39 2 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 11 39 1 0 0 0 0 12 13 2 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 14 15 2 0 0 0 0 14 32 1 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 34 1 0 0 0 0 18 35 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 39 40 1 0 0 0 0 M CHG 1 39 1 M END