OTAVA-ZINC00120527 MOE2007 3D Structure written by MMmdl. 40 42 0 0 0 0 0 0 0 0999 V2000 2.2980 10.0890 -1.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1070 9.2280 -0.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1350 6.9590 -0.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1200 5.5050 -0.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7850 4.9260 -0.5060 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6370 5.6780 -1.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6700 7.1370 -0.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6910 3.6000 -0.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7970 3.1400 0.8690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9800 3.9560 1.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1240 3.4090 2.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0740 2.0250 2.7930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8980 1.2180 2.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7670 1.7490 1.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5470 0.9060 0.3820 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3960 1.4510 -0.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5170 2.7510 -0.7730 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7570 4.2910 3.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4600 11.1480 -1.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5960 9.9200 -2.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2250 9.8990 -1.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7610 9.3200 0.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1610 9.5200 -0.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9640 7.0210 0.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0890 7.4350 -0.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8610 4.9470 -0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4320 5.4630 -1.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6650 5.6610 -2.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6790 5.2290 -0.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5100 7.2100 0.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9080 7.7180 -1.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0290 5.0370 1.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5920 1.5600 3.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8650 0.1380 2.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0480 0.7710 -1.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7000 4.4780 2.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9760 3.8260 4.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2680 5.2490 3.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0280 7.7690 -0.8150 N 0 3 0 0 0 0 0 0 0 0 0 0 3.1920 7.7110 -1.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 22 1 0 0 0 0 2 23 1 0 0 0 0 2 39 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 3 25 1 0 0 0 0 3 39 1 0 0 0 0 4 5 1 0 0 0 0 4 26 1 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 6 29 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 8 17 2 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 18 1 0 0 0 0 12 13 2 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 39 40 1 0 0 0 0 M CHG 1 39 1 M END