IBS-ZINC05253622 MOE2007 3D Structure written by MMmdl. 49 51 0 0 0 0 0 0 0 0999 V2000 9.0990 -1.3700 -1.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4780 -0.6230 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4920 0.2440 0.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0300 -0.6520 -0.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7130 0.1200 -0.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5790 -0.7870 -0.4880 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3240 -0.2670 -0.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1780 -1.0580 -0.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0640 -0.4940 0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0370 -1.5330 0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4330 -1.5770 0.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0970 -2.8060 0.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3910 -3.9780 -0.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0060 -3.9590 -0.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3580 -2.7220 -0.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9750 -2.4060 -0.3690 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6970 -3.0820 -0.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2350 0.8300 0.2730 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9080 1.5230 0.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1500 1.0590 -0.0250 N 0 0 0 0 0 0 0 0 0 0 0 0 7.5750 1.2970 -1.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1490 0.8910 -2.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9650 2.6310 -1.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5640 -0.6920 -1.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8850 -2.0450 -0.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3600 -1.9820 -1.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0900 -1.3520 0.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0120 0.8020 1.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2660 -0.3890 1.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0000 0.9580 0.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0640 -1.4380 0.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1110 -1.1380 -1.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5860 0.8250 -1.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7530 0.6900 0.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6870 -1.7760 -0.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9880 -0.6670 0.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1740 -2.8460 0.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9270 -4.9230 -0.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4610 -4.8730 -0.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8260 2.5930 0.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6600 1.4330 -1.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0630 0.8460 -3.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5120 1.6280 -3.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5670 -0.0770 -3.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3150 2.9220 -0.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2640 3.4230 -1.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8730 2.6080 -1.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2680 0.2270 -0.4550 N 0 3 0 0 0 0 0 0 0 0 0 0 7.0500 0.7550 0.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 48 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 4 48 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 20 2 0 0 0 0 8 9 2 0 0 0 0 8 16 1 0 0 0 0 9 10 1 0 0 0 0 9 18 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 13 14 2 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 41 1 0 0 0 0 21 48 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 48 49 1 0 0 0 0 M CHG 1 48 1 M END