IFLAB-ZINC04942310 MOE2007 3D Structure written by MMmdl. 46 49 0 0 0 0 0 0 0 0999 V2000 7.4690 1.8750 0.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4500 2.1900 -0.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3910 3.2040 -1.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7220 3.8220 -0.0240 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5290 4.3350 1.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5780 3.3070 1.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3780 4.1370 -0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3600 3.2020 -0.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5290 1.8000 -0.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4440 0.9650 -0.7110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8260 1.5110 -0.8090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0000 2.8840 -0.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0670 3.7340 -0.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1920 5.0270 -0.1640 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8240 5.8440 0.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0940 5.4320 0.2110 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6410 7.2030 0.3820 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4810 8.0390 0.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7880 7.5970 0.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8680 8.4820 0.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6480 9.8220 0.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3670 10.2930 0.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2910 9.4030 0.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6830 10.6710 0.5160 F 0 0 0 0 0 0 0 0 0 0 0 0 8.0310 1.6000 -0.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1220 2.4020 1.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0230 0.9930 1.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9910 1.3100 -0.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0720 1.8770 -1.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6940 2.7160 -1.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8800 3.9990 -1.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0260 5.2600 0.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9120 4.5800 1.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1080 2.4300 1.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2880 3.7550 2.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5080 1.3450 -0.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5900 -0.1060 -0.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6840 0.8750 -1.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0040 3.3000 -0.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5350 7.6290 0.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9960 6.5560 -0.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8760 8.1280 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2090 11.3440 0.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7070 9.7890 0.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3720 2.8120 0.3240 N 0 3 0 0 0 0 0 0 0 0 0 0 6.8210 3.6310 -0.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 45 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 2 45 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 5 33 1 0 0 0 0 6 34 1 0 0 0 0 6 35 1 0 0 0 0 6 45 1 0 0 0 0 7 8 1 0 0 0 0 7 16 2 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 11 12 2 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 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 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 23 44 1 0 0 0 0 45 46 1 0 0 0 0 M CHG 1 45 1 M END