BA7CL9 -OEChem-04022106353D 31 33 0 0 0 0 0 0 0999 V2000 -1.2273 1.1728 0.0013 S 0 0 0 0 0 0 0 0 0 0 0 0 4.2532 2.3776 -0.0031 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5669 0.7734 0.0011 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4555 1.5470 0.0015 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7788 -0.6169 0.0025 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9762 -1.5457 0.0013 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1604 -0.5437 0.0021 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4229 0.6489 0.0022 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8612 1.2188 -0.0008 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0532 -0.4347 0.0009 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3222 -1.2008 -0.0004 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5513 -0.3028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8043 0.0620 -0.0016 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2332 -0.2429 -1.2083 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2345 -0.2423 1.2076 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2627 -2.3722 -0.0022 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6227 -0.1202 -1.2092 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6240 -0.1197 1.2068 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3180 -0.0586 -0.0017 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4560 2.5570 -0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7413 -1.0102 0.8808 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7402 -1.0104 -0.8785 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8656 0.2824 -0.0034 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7020 -0.2888 -2.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7043 -0.2879 2.1548 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0987 -2.9909 0.8865 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3131 -2.0624 -0.0042 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0954 -2.9910 -0.8901 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1632 -0.0722 -2.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1655 -0.0714 2.1469 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3998 0.0371 -0.0022 H 0 0 0 0 0 0 0 0 0 0 0 0 1 8 1 0 0 0 0 1 10 1 0 0 0 0 2 9 2 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 3 9 1 0 0 0 0 4 8 1 0 0 0 0 4 20 1 0 0 0 0 5 7 1 0 0 0 0 5 8 2 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 9 13 1 0 0 0 0 10 12 1 0 0 0 0 10 21 1 0 0 0 0 10 22 1 0 0 0 0 11 13 2 0 0 0 0 11 16 1 0 0 0 0 12 14 2 0 0 0 0 12 15 1 0 0 0 0 13 23 1 0 0 0 0 14 17 1 0 0 0 0 14 24 1 0 0 0 0 15 18 2 0 0 0 0 15 25 1 0 0 0 0 16 26 1 0 0 0 0 16 27 1 0 0 0 0 16 28 1 0 0 0 0 17 19 2 0 0 0 0 17 29 1 0 0 0 0 18 19 1 0 0 0 0 18 30 1 0 0 0 0 19 31 1 0 0 0 0 M END $$$$