B6EG4A -OEChem-04022101353D 45 46 0 1 0 0 0 0 0999 V2000 -2.9270 -0.5206 0.1074 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5755 -0.5864 -1.3347 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4669 0.5136 0.6503 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7468 0.7580 0.3577 N 0 0 1 0 0 0 0 0 0 0 0 0 -7.0985 1.0323 0.9481 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4118 0.3375 0.7935 C 0 0 1 0 0 0 0 0 0 0 0 0 2.7144 -0.4249 -0.3478 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5630 -0.5095 2.0571 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2096 -0.4510 -0.2265 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4315 -0.3435 -0.3154 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6505 1.9190 -0.5244 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5833 -1.4846 0.4702 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4456 0.5591 -0.8111 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8068 -1.5081 0.5821 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9445 0.5356 -0.6993 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5707 -0.4979 -0.0027 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9136 -0.0967 -0.2557 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6465 0.5433 -0.5146 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1132 0.3595 -0.2564 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8449 -0.6075 -0.9368 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7810 1.1468 0.6678 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2026 -0.7555 -0.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7768 0.0816 0.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8270 1.2229 1.0776 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0655 -1.4643 -0.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9221 0.0060 -1.3343 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0004 -1.4949 1.8703 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1839 0.0020 2.8019 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5852 -0.6750 2.5226 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1369 -0.4478 -1.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2991 -1.3125 0.1773 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1371 2.7453 -0.0189 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1329 1.7263 -1.4693 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6493 2.2974 -0.7708 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1664 -2.2787 0.9288 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9230 1.3706 -1.3542 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2892 -2.3158 1.1257 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4728 1.3509 -1.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4888 0.5403 -1.6012 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3381 1.5125 -0.1015 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5377 -0.4006 -1.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3667 -1.2504 -1.6707 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2660 1.9174 1.2331 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7926 -1.5027 -1.1942 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8323 0.0064 0.5068 H 0 0 0 0 0 0 0 0 0 0 0 0 1 16 1 0 0 0 0 1 18 1 0 0 0 0 2 17 1 0 0 0 0 2 41 1 0 0 0 0 3 17 2 0 0 0 0 4 6 1 0 0 0 0 4 10 1 0 0 0 0 4 11 1 0 0 0 0 5 21 1 0 0 0 0 5 23 2 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 24 1 0 0 0 0 7 9 1 0 0 0 0 7 25 1 0 0 0 0 7 26 1 0 0 0 0 8 27 1 0 0 0 0 8 28 1 0 0 0 0 8 29 1 0 0 0 0 9 12 2 0 0 0 0 9 13 1 0 0 0 0 10 17 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 14 1 0 0 0 0 12 35 1 0 0 0 0 13 15 2 0 0 0 0 13 36 1 0 0 0 0 14 16 2 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 21 2 0 0 0 0 20 22 2 0 0 0 0 20 42 1 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 23 45 1 0 0 0 0 M END $$$$