IBS-ZINC05460321 MOE2007 3D Structure written by MMmdl. 48 52 0 0 1 0 0 0 0 0999 V2000 2.5330 1.0020 -0.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2250 1.6920 -0.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 0.9510 -0.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1790 1.5930 0.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2310 2.9830 0.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0590 3.7510 0.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1640 3.0900 -0.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0870 5.2660 0.2040 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9300 5.6460 0.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6730 5.8430 -1.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9670 7.3320 -0.9170 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5560 7.6430 -1.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8280 7.6330 0.2270 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6780 6.7970 1.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8730 5.7340 1.3490 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8490 5.2870 2.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1040 4.3060 3.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3860 4.1220 4.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3610 4.8880 5.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0970 5.8800 4.7030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8040 6.0520 3.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2840 8.1960 -0.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8280 8.7610 0.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9940 9.5300 0.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6220 9.7390 -1.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1080 9.1940 -2.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9440 8.4240 -2.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7380 10.4780 -1.0800 F 0 0 0 0 0 0 0 0 0 0 0 0 2.7090 0.9250 -1.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3620 1.5530 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5360 -0.0050 -0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0650 -0.1330 -0.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0930 1.0080 0.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1970 3.4590 0.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0860 3.6630 -0.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 5.6520 -1.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6240 5.3450 -1.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4480 8.4350 0.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6470 3.7140 2.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1640 3.3640 5.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5410 4.7060 6.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8420 6.4810 5.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3660 8.6220 1.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4140 9.9680 1.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6120 9.3690 -3.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5550 8.0040 -3.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3010 6.9450 2.4370 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.9980 7.6510 2.6400 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 34 1 0 0 0 0 6 7 1 0 0 0 0 6 8 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