B2US6K -OEChem-04012117102D 37 39 0 0 0 0 0 0 0999 V2000 5.1854 -2.7673 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 8.6938 0.3020 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6822 -2.7673 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.3319 -0.2052 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5357 -0.2052 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4601 1.2914 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4075 1.2914 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1738 0.3020 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9338 0.2673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9338 1.2673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7998 -0.2327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0678 -0.2327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7998 -1.2327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0678 -1.2327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7998 1.7673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9338 -1.7327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6938 -1.7674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1738 -1.7674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7998 2.7673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5998 -0.2119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2678 -0.2119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5998 -1.2535 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2678 -1.2535 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4639 0.2914 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4037 0.2914 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7218 1.8499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3232 1.1596 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0119 1.1847 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4104 1.8750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9338 -2.3527 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4198 2.7673 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7998 3.3873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1798 2.7673 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1356 -1.5656 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.5656 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8676 0.1069 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.1069 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 18 1 0 0 0 0 2 11 1 0 0 0 0 2 20 1 0 0 0 0 3 17 2 0 0 0 0 4 24 1 0 0 0 0 4 36 1 0 0 0 0 5 25 1 0 0 0 0 5 37 1 0 0 0 0 6 24 2 0 0 0 0 7 25 2 0 0 0 0 8 12 1 0 0 0 0 8 21 2 0 0 0 0 9 10 1 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 10 15 1 0 0 0 0 10 26 1 0 0 0 0 10 27 1 0 0 0 0 11 13 1 0 0 0 0 12 14 2 0 0 0 0 13 16 2 0 0 0 0 13 17 1 0 0 0 0 14 16 1 0 0 0 0 14 18 1 0 0 0 0 15 19 1 0 0 0 0 15 28 1 0 0 0 0 15 29 1 0 0 0 0 16 30 1 0 0 0 0 17 22 1 0 0 0 0 18 23 2 0 0 0 0 19 31 1 0 0 0 0 19 32 1 0 0 0 0 19 33 1 0 0 0 0 20 22 2 0 0 0 0 20 24 1 0 0 0 0 21 23 1 0 0 0 0 21 25 1 0 0 0 0 22 34 1 0 0 0 0 23 35 1 0 0 0 0 M END $$$$