B27NKA -OEChem-04012113143D 42 44 0 1 0 0 0 0 0999 V2000 5.3966 0.4144 0.2841 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6170 -0.1497 -0.0299 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1161 -1.6423 0.0293 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5189 0.6322 -0.1136 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7053 2.0353 0.0567 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9449 0.6349 -0.3262 C 0 0 1 0 0 0 0 0 0 0 0 0 2.3068 1.9939 0.2580 C 0 0 2 0 0 0 0 0 0 0 0 0 3.0077 -0.2273 0.3487 C 0 0 2 0 0 0 0 0 0 0 0 0 1.2888 2.8868 -0.4077 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0253 2.0245 -0.1903 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2185 0.7326 0.2249 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3030 -1.5429 -0.3499 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2884 -0.4856 -0.0346 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4526 -2.2610 0.2925 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5684 -2.6169 -0.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5412 -1.2405 0.0555 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9403 -0.6987 0.0489 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5595 -0.3758 1.2513 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6056 -0.5248 -1.1596 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8604 0.1275 1.2452 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9065 -0.0214 -1.1658 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5339 0.3046 0.0367 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0952 0.6115 -1.4176 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1443 2.0252 1.3475 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7871 -0.3786 1.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5010 3.0120 -1.4759 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2068 3.8770 0.0479 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4709 2.2584 0.7578 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6934 2.1281 -1.0088 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2772 2.8734 0.0261 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5145 -1.3675 -1.4127 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4336 -2.2038 -0.3096 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3563 -2.5190 1.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3609 -3.1426 0.1674 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7122 -2.3917 -1.4049 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3589 -1.8084 0.9764 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3929 -1.9182 -0.7945 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0433 -0.5078 2.1982 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1257 -0.7735 -2.1022 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3487 0.3819 2.1814 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4308 0.1173 -2.1068 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5467 0.6968 0.0318 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 2 0 0 0 0 2 13 1 0 0 0 0 2 16 1 0 0 0 0 3 13 2 0 0 0 0 4 6 1 0 0 0 0 4 10 1 0 0 0 0 4 13 1 0 0 0 0 5 7 1 0 0 0 0 5 11 1 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 23 1 0 0 0 0 7 9 1 0 0 0 0 7 24 1 0 0 0 0 8 11 1 0 0 0 0 8 12 1 0 0 0 0 8 25 1 0 0 0 0 9 10 1 0 0 0 0 9 26 1 0 0 0 0 9 27 1 0 0 0 0 10 28 1 0 0 0 0 10 29 1 0 0 0 0 12 14 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 14 15 2 0 0 0 0 14 33 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 18 20 1 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 22 2 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 22 42 1 0 0 0 0 M END $$$$