IFLAB-ZINC04315382 MOE2007 3D Structure written by MMmdl. 45 48 0 0 1 0 0 0 0 0999 V2000 -5.3810 0.1990 -5.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1320 -0.9690 -5.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3040 -1.0830 -4.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7230 -0.0330 -3.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9660 1.1460 -3.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7950 1.2480 -4.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3520 2.3030 -2.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4030 1.2910 -0.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9320 1.5400 0.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4110 1.5170 1.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7610 2.5030 0.0980 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.0320 3.5210 0.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2640 2.2780 -1.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2580 2.5060 0.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4520 1.4400 0.2490 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7550 0.4720 0.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1280 1.8300 0.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 1.0940 0.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2310 1.8440 0.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2210 3.2520 0.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 3.9810 0.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1380 3.2220 0.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2120 -0.2460 -2.9300 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -4.4750 0.2970 -5.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8140 -1.7850 -5.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8920 -1.9950 -4.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1920 2.1540 -4.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4380 2.4030 -2.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0180 3.2430 -3.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1020 0.2980 -0.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4880 1.4080 -0.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3570 0.7780 1.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3080 2.5100 1.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0510 0.5000 0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1070 1.7550 2.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8950 3.0640 -1.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9390 1.3020 -1.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0440 0.0140 0.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1880 1.3260 0.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1700 3.7880 0.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0060 5.0610 0.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4680 3.5870 0.1080 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.7900 4.5500 0.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7730 2.3180 -1.3720 N 0 3 0 0 0 0 0 0 0 0 0 0 -7.0690 3.2340 -1.0050 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 23 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 28 1 0 0 0 0 7 29 1 0 0 0 0 7 44 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 8 44 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 14 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 13 44 1 0 0 0 0 14 15 1 0 0 0 0 14 42 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 22 2 0 0 0 0 18 19 2 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 20 21 2 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 22 42 1 0 0 0 0 42 43 1 0 0 0 0 44 45 1 0 0 0 0 M CHG 1 42 1 M CHG 1 44 1 M END