IBS-ZINC05459505 MOE2007 3D Structure written by MMmdl. 48 52 0 0 1 0 0 0 0 0999 V2000 1.7690 -1.2290 5.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1210 -0.5320 4.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2490 0.8520 4.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6210 1.5060 3.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1630 0.7910 2.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2900 -0.5980 2.7030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3370 -1.2500 3.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8180 1.5200 1.3800 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8140 2.6010 1.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0610 1.2130 0.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8520 1.6940 -1.1240 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.3600 1.2770 -2.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2140 1.1610 -1.1810 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7830 0.9540 0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2260 1.1430 1.2220 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2240 1.0350 2.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2270 1.2510 3.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4390 1.0060 4.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5900 0.5730 3.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5840 0.3700 2.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3770 0.6190 1.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8360 3.2040 -1.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9280 4.0270 -0.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8480 5.4130 -1.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6780 5.9850 -1.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4170 5.1980 -1.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3390 3.8130 -1.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6070 7.3140 -1.7670 F 0 0 0 0 0 0 0 0 0 0 0 0 1.0880 -1.2430 6.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0320 -2.2600 5.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6950 -0.7230 6.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8450 1.4280 5.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7530 2.5820 3.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8830 -1.1880 2.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2140 -2.3250 3.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0750 0.1280 -0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9450 1.6510 0.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7220 1.0130 -2.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3470 1.5840 4.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4940 1.1540 5.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5080 0.3970 4.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4650 0.0460 1.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8610 3.6190 -0.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6930 6.0500 -0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3230 5.6630 -2.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2080 3.2110 -2.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0380 0.5590 0.1920 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.6770 0.3070 -0.5530 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 15 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 22 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 47 2 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 19 20 2 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 45 1 0 0 0 0 27 46 1 0 0 0 0 47 48 1 0 0 0 0 M CHG 1 47 1 M END