IBS-ZINC05345756 MOE2007 3D Structure written by MMmdl. 48 50 0 0 0 0 0 0 0 0999 V2000 -4.5350 5.9320 -8.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0780 4.5560 -7.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2700 4.0030 -6.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6560 4.2680 -5.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9320 3.7730 -4.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8010 2.9960 -4.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4180 2.7310 -5.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1640 3.2410 -6.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2170 1.9060 -6.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8320 1.6410 -7.1510 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5070 1.4200 -4.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9850 1.7490 -3.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0850 2.4980 -3.4420 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2680 1.2580 -2.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7280 0.5740 -2.5340 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7210 1.5710 -1.1790 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0130 1.0860 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7290 1.5790 1.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 1.0800 2.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3470 -0.1330 3.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3240 -0.5930 4.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3370 0.1640 4.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6810 1.3800 4.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0120 1.8380 3.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1900 -0.4200 6.1540 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0480 -1.8340 6.1620 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4600 0.2180 6.1580 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3720 0.1450 7.4790 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1190 6.3320 -8.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6070 6.6060 -7.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4920 5.8390 -8.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0060 3.8820 -8.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1210 4.6490 -7.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5320 4.8710 -5.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2410 3.9860 -3.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8670 3.0370 -7.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3790 0.8100 -4.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5160 2.1180 -1.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0100 1.4630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7440 2.6690 1.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7510 1.2020 1.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1410 -0.7230 2.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0560 -1.5430 4.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4720 1.9720 4.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2810 2.7880 2.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3750 -0.3650 8.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8910 0.9860 7.4300 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 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 6 7 2 0 0 0 0 6 13 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 36 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 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 18 42 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 43 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 24 46 1 0 0 0 0 25 26 2 0 0 0 0 25 27 2 0 0 0 0 25 28 1 0 0 0 0 28 47 1 0 0 0 0 28 48 1 0 0 0 0 M END