IBS-ZINC02268636 MOE2007 3D Structure written by MMmdl. 50 54 0 0 0 0 0 0 0 0999 V2000 -1.2440 0.5140 -1.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2590 1.3330 0.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0910 1.3130 0.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3570 0.9210 1.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4450 1.7140 1.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8060 3.0240 1.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9840 3.4990 1.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7570 2.6990 2.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3890 1.3830 2.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2220 0.9250 2.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5020 -0.2740 1.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6220 -1.2840 1.4200 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9730 -2.4790 1.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0530 -3.6160 1.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2350 -3.5930 2.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7300 -2.5500 2.9910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0080 -2.5980 3.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8250 -3.6920 3.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3620 -4.7380 2.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0780 -4.7040 1.9490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6300 -5.7800 1.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6450 -5.7950 0.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5170 -4.7020 0.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7840 -4.7580 0.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1720 -5.8550 -0.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3040 -6.9240 -0.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0490 -6.8930 -0.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9770 -0.5310 -0.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5180 0.9250 -1.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2310 0.5280 -1.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4470 2.3730 -0.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8650 1.7630 0.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 1.8800 1.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4130 0.2970 1.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2160 3.6430 0.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3110 4.5170 1.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6630 3.1150 2.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9730 0.7570 3.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9750 -2.7370 2.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1250 -1.6750 3.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3600 -1.7800 4.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8210 -3.7360 3.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0170 -5.5900 2.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2930 -6.6310 1.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4940 -3.9390 0.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1490 -5.8700 -1.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5990 -7.7810 -1.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3820 -7.7410 -0.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5860 -0.2900 2.3480 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.8900 -1.0520 2.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 31 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 11 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 8 9 2 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 10 49 1 0 0 0 0 11 12 1 0 0 0 0 11 49 2 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 14 15 2 0 0 0 0 14 23 1 0 0 0 0 15 16 1 0 0 0 0 15 20 1 0 0 0 0 16 17 2 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 18 19 2 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 25 26 2 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 27 48 1 0 0 0 0 49 50 1 0 0 0 0 M CHG 1 49 1 M END