B2MCJ3 -OEChem-04022113203D 40 42 0 0 0 0 0 0 0999 V2000 6.9095 2.9747 1.2092 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.9909 -2.0879 -0.0016 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9547 -0.9968 0.4441 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8136 -2.7804 0.0094 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6406 0.8914 -0.9100 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4331 0.0893 0.4005 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.2064 1.4354 -0.3061 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.1130 2.0304 -0.9927 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4962 0.2796 -0.2259 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9244 -1.0363 -0.0825 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8130 0.9815 -0.2349 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4524 1.2953 -0.3023 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0686 0.5519 -0.2911 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1864 -0.4514 -0.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2770 -1.3644 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2239 -0.3456 -0.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6192 -1.8586 -0.0612 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8309 2.0689 -0.3185 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2309 -0.0770 -0.2899 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3253 -0.7264 0.4343 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8814 0.0946 1.4154 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1375 -1.2762 -0.5575 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0618 -0.1841 0.4128 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2496 0.3657 1.4046 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5057 -1.0050 -0.5683 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8659 1.1314 -0.2687 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1405 2.3313 -0.4167 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7631 1.5883 -0.3973 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5946 -2.3965 0.0981 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2797 -0.5976 -0.0364 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5838 2.7710 -1.1218 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8314 1.6753 -0.5252 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2538 0.5255 2.1906 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7100 -1.9166 -1.3241 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6735 1.0066 2.1734 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1301 -1.4382 -1.3452 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8871 0.8626 0.1811 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5541 2.2378 -0.8196 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1049 1.9518 -1.0692 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5495 2.8074 -1.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 1 18 1 0 0 0 0 2 10 1 0 0 0 0 2 17 1 0 0 0 0 3 19 1 0 0 0 0 3 20 1 0 0 0 0 4 17 2 0 0 0 0 5 19 2 0 0 0 0 6 23 1 0 0 0 0 6 26 2 0 0 0 0 7 26 1 0 0 0 0 7 37 1 0 0 0 0 7 38 1 0 0 0 0 8 26 1 0 0 0 0 8 39 1 0 0 0 0 8 40 1 0 0 0 0 9 10 2 0 0 0 0 9 12 1 0 0 0 0 9 13 1 0 0 0 0 10 15 1 0 0 0 0 11 12 2 0 0 0 0 11 16 1 0 0 0 0 11 18 1 0 0 0 0 12 27 1 0 0 0 0 13 14 2 0 0 0 0 13 28 1 0 0 0 0 14 17 1 0 0 0 0 14 19 1 0 0 0 0 15 16 2 0 0 0 0 15 29 1 0 0 0 0 16 30 1 0 0 0 0 18 31 1 0 0 0 0 18 32 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 21 24 1 0 0 0 0 21 33 1 0 0 0 0 22 25 2 0 0 0 0 22 34 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 24 35 1 0 0 0 0 25 36 1 0 0 0 0 M END $$$$