B1XH2D -OEChem-04042107313D 40 42 0 0 0 0 0 0 0999 V2000 7.4691 0.6358 0.1901 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.5329 1.1458 -0.4407 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.6070 0.0737 0.5814 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0337 0.5041 -0.5551 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3812 -1.1949 -0.0151 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9686 -1.3700 0.1189 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.5106 1.0385 0.4668 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1040 -0.4969 -0.4408 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0065 1.1102 -0.9802 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3628 0.6950 1.4259 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2277 -0.1355 -1.4127 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5828 -0.5552 1.0104 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8411 0.0582 -0.3377 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5737 -0.2332 -0.0708 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2159 -2.3662 0.1344 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0020 -0.0226 -0.0064 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8817 -1.1032 -0.1352 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5189 1.2640 0.1833 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2604 -0.9000 -0.0747 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8976 1.4673 0.2437 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7684 0.3853 0.1145 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9132 2.0190 0.7466 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8538 -1.4591 -0.8543 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9244 -0.9794 -1.4966 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8199 0.0321 -2.4176 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7494 -0.6466 1.7156 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2185 -1.4384 1.1469 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3554 1.9883 -1.0812 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8433 1.2748 -1.6706 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7484 0.5622 2.4446 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6737 1.5485 1.4701 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2857 -0.8610 0.3359 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3386 0.3053 -0.0896 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5776 -3.1809 0.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5505 -2.7674 -0.8281 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9812 -2.3243 0.9024 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5096 -2.1132 -0.2875 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8926 2.1405 0.3161 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9271 -1.7523 -0.1776 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2799 2.4733 0.3974 H 0 0 0 0 0 0 0 0 0 0 0 0 1 21 1 0 0 0 0 2 13 1 0 0 0 0 2 14 1 0 0 0 0 3 7 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 8 1 0 0 0 0 4 13 2 0 0 0 0 5 6 1 0 0 0 0 5 13 1 0 0 0 0 5 15 1 0 0 0 0 6 14 2 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 7 22 1 0 0 0 0 8 11 1 0 0 0 0 8 12 1 0 0 0 0 8 23 1 0 0 0 0 9 11 1 0 0 0 0 9 28 1 0 0 0 0 9 29 1 0 0 0 0 10 12 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 11 24 1 0 0 0 0 11 25 1 0 0 0 0 12 26 1 0 0 0 0 12 27 1 0 0 0 0 14 16 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 17 2 0 0 0 0 16 18 1 0 0 0 0 17 19 1 0 0 0 0 17 37 1 0 0 0 0 18 20 2 0 0 0 0 18 38 1 0 0 0 0 19 21 2 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 M END $$$$