B48NCB -OEChem-04022103253D 36 38 0 0 0 0 0 0 0999 V2000 -4.1494 -1.9976 -0.1086 S 0 0 0 0 0 0 0 0 0 0 0 0 1.1959 3.4014 -0.0010 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5072 -2.1912 -1.6916 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2102 -3.0507 0.2471 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3969 -1.8374 0.6211 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1012 3.0071 0.1756 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2065 0.3371 -0.3580 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2361 0.8015 0.1918 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2401 0.7938 -0.0677 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9882 1.9548 0.1393 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1249 1.1863 -0.1544 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9132 -0.4417 -0.1456 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3063 -0.4698 -0.0142 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1781 2.5527 -0.0009 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3812 1.9420 0.2724 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0270 0.7049 0.1915 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3298 -0.0569 -0.0132 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6125 -1.0812 0.8904 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1368 0.1248 -1.1363 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7022 -1.9238 0.6709 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7624 -1.2960 2.0997 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2266 -0.7179 -1.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5092 -1.7422 -0.4524 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3439 -1.3513 -0.3128 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3597 3.9744 0.3128 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9431 2.8563 0.4307 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1101 0.6877 0.2856 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8454 4.2988 0.1372 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9256 0.9205 -1.8461 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9357 -2.7274 1.3642 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7679 -1.6490 1.8084 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1956 -2.0430 2.7738 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6626 -0.3676 2.6721 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8550 -0.5764 -2.2304 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3575 -2.3984 -0.6236 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9913 -3.0206 -1.9149 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 1 0 0 0 0 1 4 2 0 0 0 0 1 5 2 0 0 0 0 1 13 1 0 0 0 0 2 14 1 0 0 0 0 2 28 1 0 0 0 0 3 36 1 0 0 0 0 6 10 1 0 0 0 0 6 14 1 0 0 0 0 6 25 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 17 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 9 12 1 0 0 0 0 10 15 1 0 0 0 0 11 14 2 0 0 0 0 12 13 2 0 0 0 0 12 24 1 0 0 0 0 13 16 1 0 0 0 0 15 16 2 0 0 0 0 15 26 1 0 0 0 0 16 27 1 0 0 0 0 17 18 1 0 0 0 0 17 19 2 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 19 22 1 0 0 0 0 19 29 1 0 0 0 0 20 23 1 0 0 0 0 20 30 1 0 0 0 0 21 31 1 0 0 0 0 21 32 1 0 0 0 0 21 33 1 0 0 0 0 22 23 2 0 0 0 0 22 34 1 0 0 0 0 23 35 1 0 0 0 0 M END $$$$