IFLAB-ZINC02719641 MOE2007 3D Structure written by MMmdl. 40 42 0 0 0 0 0 0 0 0999 V2000 -4.6030 9.3420 6.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5770 10.6010 5.6570 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9010 11.4540 6.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0290 10.5020 4.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7410 9.1590 4.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1050 8.4430 5.3710 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1570 8.7660 3.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9220 9.7420 2.1070 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2590 11.0200 2.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8190 11.4970 3.5400 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8410 7.4410 2.7910 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2460 7.0160 1.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0440 5.4970 1.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4310 4.9990 0.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2440 2.9530 -1.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3120 1.4330 -1.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2420 0.8250 -0.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3110 1.4080 1.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2460 2.9290 1.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9930 9.1470 7.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0490 11.7560 1.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0510 6.7890 3.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2790 7.5120 1.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8970 7.2850 0.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0090 5.0030 1.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4030 5.2380 2.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4190 5.3860 0.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0670 5.2960 -0.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3000 3.3200 -1.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0820 3.3650 -1.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1920 1.0550 -2.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3030 1.1110 -0.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3650 -0.2630 -0.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7490 1.0190 -0.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2420 1.0850 1.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5140 1.0130 1.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7060 3.2940 0.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3910 3.3180 2.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3540 3.4780 0.2480 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.2480 3.1290 0.6220 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 20 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 10 2 0 0 0 0 5 6 1 0 0 0 0 5 7 2 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 21 1 0 0 0 0 11 12 1 0 0 0 0 11 22 1 0 0 0 0 12 13 1 0 0 0 0 12 23 1 0 0 0 0 12 24 1 0 0 0 0 13 14 1 0 0 0 0 13 25 1 0 0 0 0 13 26 1 0 0 0 0 14 27 1 0 0 0 0 14 28 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 29 1 0 0 0 0 15 30 1 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 31 1 0 0 0 0 16 32 1 0 0 0 0 17 18 1 0 0 0 0 17 33 1 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 39 40 1 0 0 0 0 M CHG 1 39 1 M END