IBS-ZINC05270025 MOE2007 3D Structure written by MMmdl. 59 62 0 0 0 0 0 0 0 0999 V2000 0.7950 -3.8500 -0.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6560 -2.3420 -0.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7170 -1.7260 -0.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7500 -0.3690 -0.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4790 0.3430 -0.2950 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6990 -0.3210 -0.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7680 -1.6790 -0.1770 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6700 0.6560 -0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9660 1.8690 -0.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6530 1.7010 -0.2740 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0930 0.4040 0.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5680 -0.6470 0.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9400 -0.8650 1.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8520 -0.0330 0.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3920 1.0180 -0.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0200 1.2380 -0.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9280 0.3950 -0.5270 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7660 0.4200 -1.7330 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2590 0.2880 -1.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7910 1.1820 0.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3120 1.3480 0.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1350 1.2280 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0580 1.5810 -1.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8430 0.6630 -1.7130 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1060 3.0250 -1.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9290 -2.6200 -0.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1520 -3.2920 -1.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3830 -4.6030 -1.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5630 -4.2330 -1.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8250 -4.1360 -0.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1420 -4.3090 0.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3570 2.8770 -0.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8770 -1.3050 1.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2940 -1.6860 1.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9190 -0.2050 0.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1000 1.6660 -0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6910 2.0600 -1.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5950 1.3730 -2.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4800 -0.3670 -2.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4990 -0.7010 -0.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8570 0.4740 -2.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9880 0.1950 1.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1010 1.9640 1.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7110 1.1970 1.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1290 2.3700 0.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3140 0.2130 0.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3030 1.9220 0.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5240 0.9300 -2.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8400 -0.3810 -1.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3610 3.6580 -0.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1360 3.3450 -1.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8540 3.2060 -2.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8560 -3.3560 0.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8300 -2.0480 -0.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1340 -2.6720 -2.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4180 -5.2770 -1.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5400 -5.0340 -2.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6670 1.3100 -0.3440 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.5050 2.2450 -0.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 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 26 1 0 0 0 0 4 5 1 0 0 0 0 4 17 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 6 8 2 0 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 9 10 2 0 0 0 0 9 32 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 14 15 2 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 19 58 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 20 58 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 22 58 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 25 52 1 0 0 0 0 26 27 1 0 0 0 0 26 53 1 0 0 0 0 26 54 1 0 0 0 0 27 28 2 0 0 0 0 27 55 1 0 0 0 0 28 56 1 0 0 0 0 28 57 1 0 0 0 0 58 59 1 0 0 0 0 M CHG 1 58 1 M END