IFLAB-ZINC02719645 MOE2007 3D Structure written by MMmdl. 47 49 0 0 1 0 0 0 0 0999 V2000 9.0860 0.1000 -3.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6480 0.9440 -1.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8690 0.2140 -0.5450 C 0 0 3 0 0 0 0 0 0 0 0 0 10.0950 0.9560 0.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0370 -0.7790 -0.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3070 -1.5250 0.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0510 -2.2350 1.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8970 -1.2620 1.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3740 0.3490 0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0920 -0.4860 0.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8510 0.4150 0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6450 -0.3930 0.0520 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4040 0.2150 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 -0.5030 -0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0060 0.1950 -0.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4910 -2.6250 0.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4860 -1.9620 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8480 -1.8420 0.0450 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1410 1.5520 -0.2310 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0590 2.1650 -0.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2900 1.5820 -0.1350 N 0 0 0 0 0 0 0 0 0 0 0 0 9.7410 -0.7410 -3.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0920 -0.2910 -2.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9910 0.7130 -3.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0030 1.8170 -1.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6090 1.3620 -2.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8360 -1.5140 -1.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9470 -0.2430 -0.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1130 -2.2530 0.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6480 -0.8210 1.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7780 -3.0210 0.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2460 -2.7310 2.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1090 -0.4970 2.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9950 -1.8110 1.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3390 1.0070 -0.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4940 0.9600 0.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0420 -1.0970 1.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0790 -1.1780 -0.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8850 1.0200 -0.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8550 1.0950 0.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7120 -1.3990 0.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0460 -2.8870 0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0500 3.2490 -0.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9980 -0.7340 -0.1080 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.9830 -0.4970 -0.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6150 -0.5400 -0.0570 N 0 3 0 0 0 0 0 0 0 0 0 0 8.4150 -1.2610 -0.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 25 1 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 46 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 7 32 1 0 0 0 0 8 33 1 0 0 0 0 8 34 1 0 0 0 0 8 46 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 9 36 1 0 0 0 0 9 46 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 21 2 0 0 0 0 14 15 2 0 0 0 0 14 18 1 0 0 0 0 15 19 1 0 0 0 0 15 44 1 0 0 0 0 16 18 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 17 44 2 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 44 45 1 0 0 0 0 46 47 1 0 0 0 0 M CHG 1 44 1 M CHG 1 46 1 M END