IBS-ZINC04301413 MOE2007 3D Structure written by MMmdl. 47 50 0 0 0 0 0 0 0 0999 V2000 6.2690 0.4060 -0.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4720 -0.7210 -0.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0860 -0.5880 -0.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4820 0.6800 -0.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2930 1.8080 -0.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6800 1.6660 -0.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0640 0.7800 -0.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2470 1.9100 -0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0550 1.4630 0.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 0.0710 0.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3200 -0.3530 0.1700 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0870 2.4110 0.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7440 3.7130 -0.0250 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5560 4.0270 -0.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6080 3.1970 -0.1990 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4120 2.0480 0.2910 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4330 3.0770 0.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8310 2.4530 0.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0660 4.4430 1.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1300 5.4850 1.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4690 4.8430 0.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3160 3.8240 -0.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2510 2.7870 -0.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3470 0.3030 -0.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9260 -1.7070 -0.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4940 -1.4900 0.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8930 2.8140 -0.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3000 2.5480 -0.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7200 -0.6620 0.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7790 5.0830 -0.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6400 1.0700 0.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2690 3.7590 1.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3680 3.6590 -0.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9490 1.7010 -0.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9960 1.9680 1.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3190 3.8580 2.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1000 4.9320 1.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7980 6.1050 0.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2530 6.1560 1.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1880 5.6150 0.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8750 4.3480 1.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0540 4.3440 -1.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2750 3.3240 -0.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0910 2.1280 -0.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5160 2.1860 0.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9360 3.4790 0.1780 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.7000 4.0290 -0.6610 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 24 1 0 0 0 0 2 3 2 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 15 2 0 0 0 0 9 10 1 0 0 0 0 9 12 2 0 0 0 0 10 11 2 0 0 0 0 10 29 1 0 0 0 0 12 13 1 0 0 0 0 12 16 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 30 1 0 0 0 0 16 17 1 0 0 0 0 16 31 1 0 0 0 0 17 18 1 0 0 0 0 17 32 1 0 0 0 0 17 33 1 0 0 0 0 18 34 1 0 0 0 0 18 35 1 0 0 0 0 18 46 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 19 46 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 46 47 1 0 0 0 0 M CHG 1 46 1 M END