B4B2TU -OEChem-04022118233D 27 29 0 0 0 0 0 0 0999 V2000 -7.2427 -0.6569 -0.5345 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.4871 -0.8372 0.0433 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.4917 0.4604 -0.5696 S 0 0 0 0 0 0 0 0 0 0 0 0 2.9523 -0.9496 -0.0507 S 0 0 0 0 0 0 0 0 0 0 0 0 6.8111 -1.1021 0.4548 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3965 -2.5030 -0.6414 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5180 2.9144 0.0611 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6155 1.7088 -0.0092 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5830 0.5043 0.0307 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8637 0.1744 0.0919 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1149 1.7108 0.0636 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5270 1.5088 0.0986 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1692 -0.3802 0.1205 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9724 0.5244 -0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5509 -1.5866 0.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9475 -1.8241 0.5137 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8575 2.8204 0.0242 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5802 -0.7899 -0.1406 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6423 -0.2817 -0.0874 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6262 -1.4155 -0.1278 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2422 2.3220 0.1353 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8818 -2.2791 1.1608 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4569 -2.7102 0.8709 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3981 3.7603 0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8101 0.3037 0.8219 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7974 0.3439 -0.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4469 -1.8482 0.4155 H 0 0 0 0 0 0 0 0 0 0 0 0 1 18 1 0 0 0 0 2 9 1 0 0 0 0 2 10 1 0 0 0 0 3 13 1 0 0 0 0 3 18 1 0 0 0 0 4 14 1 0 0 0 0 4 19 1 0 0 0 0 5 20 1 0 0 0 0 5 27 1 0 0 0 0 6 20 2 0 0 0 0 7 11 1 0 0 0 0 7 17 2 0 0 0 0 8 14 2 0 0 0 0 8 17 1 0 0 0 0 9 11 2 0 0 0 0 9 14 1 0 0 0 0 10 12 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 12 21 1 0 0 0 0 13 15 2 0 0 0 0 15 16 1 0 0 0 0 15 22 1 0 0 0 0 16 18 2 0 0 0 0 16 23 1 0 0 0 0 17 24 1 0 0 0 0 19 20 1 0 0 0 0 19 25 1 0 0 0 0 19 26 1 0 0 0 0 M END $$$$