IBS-ZINC04026241 MOE2007 3D Structure written by MMmdl. 41 45 0 0 1 0 0 0 0 0999 V2000 -0.0840 -0.0440 0.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1100 1.3460 0.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0600 2.0740 0.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2560 1.3590 0.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3120 -0.0360 0.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1190 -0.7470 0.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6710 -0.4100 0.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3910 0.7520 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5380 1.8150 0.0720 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7820 2.7920 -0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8520 0.7870 -0.1940 C 0 0 3 0 0 0 0 0 0 0 0 0 6.3330 0.8620 0.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5170 1.7470 -1.1690 C 0 0 3 0 0 0 0 0 0 0 0 0 6.5820 2.7540 -0.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8130 1.8470 -2.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7320 1.9860 -3.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0640 1.8750 -3.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8080 1.6030 -2.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9280 1.1120 -1.2270 C 0 0 3 0 0 0 0 0 0 0 0 0 8.4540 1.3550 -0.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6960 -0.4120 -1.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8600 -1.7030 0.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3100 -1.7720 0.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0070 -0.5890 0.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0550 1.8730 0.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0330 3.1570 0.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1250 -1.8310 0.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1660 0.9850 -2.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1430 2.7170 -2.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2710 2.1930 -4.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6550 2.0130 -4.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3020 2.5360 -2.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6040 0.8750 -2.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7810 -0.8850 -2.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3410 -0.9160 -0.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2750 -2.6250 -0.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3030 -1.5170 1.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9420 -2.3120 -0.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0090 -2.3460 1.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2670 -0.5620 -0.7700 N 0 3 0 0 0 0 0 0 0 0 0 0 5.7190 -0.6910 -1.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 24 1 0 0 0 0 2 3 2 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 27 1 0 0 0 0 7 8 2 0 0 0 0 7 23 1 0 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 40 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 19 1 0 0 0 0 15 16 1 0 0 0 0 15 28 1 0 0 0 0 15 29 1 0 0 0 0 16 17 2 0 0 0 0 16 30 1 0 0 0 0 17 18 1 0 0 0 0 17 31 1 0 0 0 0 18 19 1 0 0 0 0 18 32 1 0 0 0 0 18 33 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 34 1 0 0 0 0 21 35 1 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 36 1 0 0 0 0 22 37 1 0 0 0 0 22 40 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 40 41 1 0 0 0 0 M CHG 1 40 1 M END