IBS-ZINC02241866 MOE2007 3D Structure written by MMmdl. 58 61 0 0 0 0 0 0 0 0999 V2000 1.9450 5.6310 0.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0630 4.1310 0.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0880 3.3310 0.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1760 1.9570 0.7130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2540 1.3600 0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2380 2.1770 -0.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1310 3.5660 -0.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3740 1.5280 -1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2620 2.1800 -1.7200 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3870 0.0580 -1.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3740 -0.6090 -0.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3580 0.0190 -0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3880 -2.0910 -0.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2970 -2.6840 -1.1730 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3920 -2.7800 -0.0360 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3540 -4.1740 -0.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1340 -4.8330 -0.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1000 -6.2100 -0.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2790 -6.9340 -0.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4950 -6.2810 -0.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5360 -4.9040 -0.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2310 -8.6910 -0.4480 S 0 0 0 0 0 0 0 0 0 0 0 0 0.9940 -9.0210 -1.0660 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4830 -9.0950 -0.9860 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1640 -9.2880 1.0950 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3960 -9.6010 1.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3230 -11.0410 2.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0400 -11.2310 3.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8250 -10.9670 2.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8700 -9.5200 1.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9800 -12.6640 3.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1090 1.1030 1.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4430 5.9890 1.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4140 6.0780 -0.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8920 5.9120 0.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2500 3.7910 1.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8880 4.1910 -0.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1900 -0.4800 -1.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7020 -2.3100 0.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2130 -4.2690 -0.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1520 -6.7230 -0.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4140 -6.8490 -0.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4860 -4.3950 -0.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2550 -9.4900 1.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4960 -8.9240 2.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1870 -11.2520 2.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3180 -11.7220 1.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0340 -10.5320 3.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0890 -11.1250 2.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8440 -11.6480 1.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7600 -8.8370 2.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0630 -9.3560 1.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9860 -13.3620 2.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8450 -12.8520 4.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0670 -12.7990 4.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3790 0.8940 2.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8440 1.6330 1.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 0.1660 0.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 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 36 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 5 6 2 0 0 0 0 5 12 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 37 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 43 1 0 0 0 0 22 23 2 0 0 0 0 22 24 2 0 0 0 0 22 25 1 0 0 0 0 25 26 1 0 0 0 0 25 30 1 0 0 0 0 26 27 1 0 0 0 0 26 44 1 0 0 0 0 26 45 1 0 0 0 0 27 28 1 0 0 0 0 27 46 1 0 0 0 0 27 47 1 0 0 0 0 28 29 1 0 0 0 0 28 31 1 0 0 0 0 28 48 1 0 0 0 0 29 30 1 0 0 0 0 29 49 1 0 0 0 0 29 50 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 31 55 1 0 0 0 0 32 56 1 0 0 0 0 32 57 1 0 0 0 0 32 58 1 0 0 0 0 M END