IBS-ZINC04869621 MOE2007 3D Structure written by MMmdl. 48 50 0 0 0 0 0 0 0 0999 V2000 3.8330 3.1810 -2.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2370 4.0480 -1.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2270 4.9490 -1.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5160 3.8220 0.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0790 4.0550 0.0410 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0930 3.0570 -0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1690 1.6650 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0470 0.9760 -0.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2740 1.6500 -0.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3420 3.0480 -0.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1300 3.7170 -0.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4690 5.2490 -0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1040 6.5500 -0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5240 7.7290 -0.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2200 9.0260 -0.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5300 9.2100 -0.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1370 10.4810 -0.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4700 11.6250 -0.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1480 11.4140 0.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5310 10.1490 0.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0750 12.8810 -0.1060 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3590 14.0510 0.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4470 13.0710 -0.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8080 3.4030 -2.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4800 3.3320 -3.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8960 2.1230 -1.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5560 5.5640 -0.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7530 5.0910 -2.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8790 4.4810 1.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6900 2.7990 0.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1100 1.1440 0.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0450 -0.1140 -0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1910 1.0670 -0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2770 3.5800 -0.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1440 6.5440 0.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4790 7.7900 -0.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1030 8.3810 -1.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1590 10.5500 -0.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5510 12.2400 0.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5030 10.0640 0.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0610 13.9120 1.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9760 14.9560 0.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4690 14.2500 -0.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5440 12.8070 -1.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7720 14.1130 -0.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1420 12.4660 0.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1600 5.0600 -0.2110 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.5290 5.7970 -0.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 12 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 10 2 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 11 47 1 0 0 0 0 12 13 1 0 0 0 0 12 47 2 0 0 0 0 13 14 2 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 41 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 47 48 1 0 0 0 0 M CHG 1 47 1 M END