BGRB74 -OEChem-04012114333D 40 41 0 1 0 0 0 0 0999 V2000 -4.3682 0.6395 1.4171 F 0 0 0 0 0 0 0 0 0 0 0 0 -4.2625 2.1108 -0.1922 F 0 0 0 0 0 0 0 0 0 0 0 0 -5.1698 0.1643 -0.5573 F 0 0 0 0 0 0 0 0 0 0 0 0 1.8886 -3.6002 -1.3163 F 0 0 0 0 0 0 0 0 0 0 0 0 -2.6971 0.3875 -1.7490 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4019 0.4352 -0.0967 N 0 0 3 0 0 0 0 0 0 0 0 0 -1.6670 0.9889 0.3325 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5272 1.2995 -0.8242 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8189 0.2418 -0.3352 C 0 0 1 0 0 0 0 0 0 0 0 0 1.8605 1.3926 -0.1402 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0665 -0.9004 0.1598 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0407 1.2874 -0.8688 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1649 0.7935 0.0915 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8943 1.5858 1.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7614 -1.6036 -0.7229 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5558 -1.5456 1.3017 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2684 1.3767 -0.2128 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0224 1.0788 -2.3476 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1221 1.6751 1.8928 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3091 1.5706 1.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0956 -2.9336 -0.4673 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2217 -2.8753 1.5572 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6040 -3.5694 0.6729 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7580 0.9680 1.4244 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7285 2.0487 0.0545 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1372 2.3237 -0.8941 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5802 0.9547 -1.8607 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8059 -0.8298 -0.1147 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9838 1.6864 1.8211 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1293 -1.1653 -1.6422 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1876 -1.0375 2.0239 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2028 1.2960 -0.7619 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4026 1.8322 -2.8448 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0272 1.1825 -2.7737 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6716 0.0769 -2.6052 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1540 1.8295 2.9674 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8456 -0.0016 -2.0115 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2650 1.6405 1.6788 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6011 -3.3698 2.4467 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8652 -4.6045 0.8721 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 1 0 0 0 0 2 13 1 0 0 0 0 3 13 1 0 0 0 0 4 21 1 0 0 0 0 5 9 1 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 11 1 0 0 0 0 7 9 1 0 0 0 0 7 24 1 0 0 0 0 7 25 1 0 0 0 0 8 10 1 0 0 0 0 8 26 1 0 0 0 0 8 27 1 0 0 0 0 9 13 1 0 0 0 0 9 28 1 0 0 0 0 10 12 1 0 0 0 0 10 14 2 0 0 0 0 11 15 2 0 0 0 0 11 16 1 0 0 0 0 12 17 2 0 0 0 0 12 18 1 0 0 0 0 14 19 1 0 0 0 0 14 29 1 0 0 0 0 15 21 1 0 0 0 0 15 30 1 0 0 0 0 16 22 2 0 0 0 0 16 31 1 0 0 0 0 17 20 1 0 0 0 0 17 32 1 0 0 0 0 18 33 1 0 0 0 0 18 34 1 0 0 0 0 18 35 1 0 0 0 0 19 20 2 0 0 0 0 19 36 1 0 0 0 0 20 38 1 0 0 0 0 21 23 2 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 23 40 1 0 0 0 0 M END $$$$