BSQ4G6 -OEChem-04042106423D 57 59 0 1 0 0 0 0 0999 V2000 2.8823 2.2698 -0.8473 S 0 0 0 0 0 0 0 0 0 0 0 0 3.0619 0.4921 1.1023 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3463 1.4025 0.9062 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3689 -0.1959 -0.7015 C 0 0 2 0 0 0 0 0 0 0 0 0 0.8770 0.8588 0.2881 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1509 -0.2258 -0.8088 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9009 -1.5891 -0.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0219 1.5844 1.0473 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9178 0.5425 -0.0098 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6553 2.2680 -0.5051 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3311 1.0859 0.3226 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3890 0.5030 -0.1029 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5815 -2.2017 0.8237 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7082 -2.2515 -1.3129 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4234 2.6112 2.0715 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3306 3.2639 -1.4524 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8748 2.6873 0.9512 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1996 0.8564 -0.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0691 -3.4767 1.1105 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1958 -3.5264 -1.0262 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8762 -4.1390 0.1855 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0703 -0.6927 0.1251 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0993 1.6615 -0.4173 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4619 -0.7299 0.0382 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4910 1.6244 -0.5043 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1722 0.4287 -0.2765 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4003 -5.5009 0.4932 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6601 0.3891 -0.3703 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7267 0.1014 -1.6976 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5937 -0.8888 -1.5482 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9598 1.9585 1.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0446 -1.7026 1.5584 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9673 -1.7863 -2.2602 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0583 3.6006 1.7764 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5061 2.6826 2.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0091 2.3609 3.0464 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1817 2.9904 -2.5038 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4128 3.2955 -1.2783 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9519 4.2829 -1.3087 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3472 3.6183 1.1925 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6150 1.9434 1.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9417 2.8896 1.1149 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9459 0.1148 0.0162 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9015 0.4617 -1.7211 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2974 0.8856 -0.7461 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8153 -3.9425 2.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8260 -4.0311 -1.7536 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5348 -1.6049 0.3774 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5848 2.6016 -0.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9816 -1.6667 0.2207 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0334 2.5337 -0.7493 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3689 -5.4255 0.9973 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7101 -6.0533 1.1399 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5249 -6.0919 -0.4205 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0097 -0.5968 -0.6951 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0293 1.1163 -1.1014 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1040 0.6150 0.6043 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 1 0 0 0 0 1 11 1 0 0 0 0 2 11 2 0 0 0 0 3 8 1 0 0 0 0 3 9 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 7 1 0 0 0 0 4 29 1 0 0 0 0 5 8 2 0 0 0 0 5 11 1 0 0 0 0 6 9 2 0 0 0 0 6 30 1 0 0 0 0 7 13 2 0 0 0 0 7 14 1 0 0 0 0 8 15 1 0 0 0 0 9 12 1 0 0 0 0 10 16 1 0 0 0 0 10 17 1 0 0 0 0 10 18 1 0 0 0 0 12 22 2 0 0 0 0 12 23 1 0 0 0 0 13 19 1 0 0 0 0 13 32 1 0 0 0 0 14 20 2 0 0 0 0 14 33 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 18 43 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 19 21 2 0 0 0 0 19 46 1 0 0 0 0 20 21 1 0 0 0 0 20 47 1 0 0 0 0 21 27 1 0 0 0 0 22 24 1 0 0 0 0 22 48 1 0 0 0 0 23 25 2 0 0 0 0 23 49 1 0 0 0 0 24 26 2 0 0 0 0 24 50 1 0 0 0 0 25 26 1 0 0 0 0 25 51 1 0 0 0 0 26 28 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 27 54 1 0 0 0 0 28 55 1 0 0 0 0 28 56 1 0 0 0 0 28 57 1 0 0 0 0 M END $$$$