IBS-ZINC02309597 MOE2007 3D Structure written by MMmdl. 46 49 0 0 0 0 0 0 0 0999 V2000 0.3530 0.2720 -1.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1450 1.5850 -0.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1040 2.0740 0.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8960 3.2800 0.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2830 4.0180 0.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2530 3.5350 -0.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0350 2.3140 -0.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4770 4.2530 -0.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7010 3.7330 -0.3170 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9190 2.7810 -0.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6290 4.7140 -0.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9060 5.8590 -0.9010 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3630 7.1640 -1.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2770 7.3210 -2.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6970 8.5950 -2.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2020 9.7240 -2.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2860 9.5820 -1.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8660 8.3090 -0.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0560 4.5000 -0.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9260 5.3740 0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3040 5.1400 0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8250 4.0290 -0.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9700 3.1480 -1.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5920 3.3790 -1.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4600 5.3030 1.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0550 -0.5410 -0.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1390 0.2660 -2.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4190 0.0850 -1.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0230 1.5190 0.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6650 3.6360 1.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7820 1.9310 -1.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6730 6.4610 -2.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4070 8.7070 -3.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5280 10.7150 -2.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9000 10.4640 -0.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1570 8.2280 0.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5510 6.2440 0.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9710 5.8240 0.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8970 3.8470 -0.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3770 2.2800 -1.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9490 2.6790 -1.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2450 6.1580 0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4780 5.3880 1.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2150 5.3520 2.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5740 5.5310 -0.7200 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.7870 6.1520 -0.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 2 0 0 0 0 5 25 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 45 2 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 19 1 0 0 0 0 12 13 1 0 0 0 0 12 45 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 32 1 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 16 17 2 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 22 23 2 0 0 0 0 22 39 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 24 41 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 45 46 1 0 0 0 0 M CHG 1 45 1 M END