IBS-ZINC05033113 MOE2007 3D Structure written by MMmdl. 50 52 0 0 0 0 0 0 0 0999 V2000 -1.6160 4.6050 -4.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2650 5.6710 -3.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5720 6.9620 -3.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2790 8.0590 -2.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2290 8.4440 -1.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9410 9.4700 -0.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7040 10.1130 -0.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2440 9.7360 -1.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0430 8.7120 -2.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5550 5.2310 -1.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2780 3.9900 -1.7250 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3710 3.8310 -0.5420 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3420 2.7210 -0.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2000 2.7050 0.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2890 3.7350 1.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5070 3.7170 0.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1350 2.5680 3.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3370 2.1600 4.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9780 3.1070 5.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2110 2.7330 6.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2010 1.4090 6.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1490 0.4560 5.6970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9170 0.8290 4.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1480 0.9490 8.0120 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -2.2790 3.8610 -3.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1290 5.0150 -5.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7120 4.0990 -4.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0950 7.2680 -4.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1980 7.9520 -1.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6830 9.7750 0.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4830 10.9170 0.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2030 10.2460 -1.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7020 8.4320 -3.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2620 6.0250 -1.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0120 2.8300 -1.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8230 1.7610 -0.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8540 1.8270 0.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8040 3.6150 0.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8280 4.6810 2.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3840 3.5720 2.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2100 4.5590 0.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1090 2.8010 0.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9380 1.8370 3.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6020 3.5520 3.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2890 4.1470 5.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0600 3.4770 7.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1690 -0.5770 5.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1870 0.0670 3.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3160 2.6190 1.9510 N 0 3 0 0 0 0 0 0 0 0 0 0 0.8000 1.7310 1.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 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 2 3 2 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 2 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 33 1 0 0 0 0 10 11 2 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 14 49 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 15 49 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 17 49 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 45 1 0 0 0 0 20 21 1 0 0 0 0 20 46 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 47 1 0 0 0 0 23 48 1 0 0 0 0 49 50 1 0 0 0 0 M CHG 1 49 1 M END