B0TRE7 -OEChem-04022114093D 48 51 0 0 0 0 0 0 0999 V2000 -5.0923 1.1489 -0.1813 S 0 0 0 0 0 0 0 0 0 0 0 0 5.2412 -1.5313 0.1296 F 0 0 0 0 0 0 0 0 0 0 0 0 4.4039 -0.3136 1.7245 F 0 0 0 0 0 0 0 0 0 0 0 0 4.7138 -2.4375 2.0344 F 0 0 0 0 0 0 0 0 0 0 0 0 -2.5211 2.0509 -0.0853 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7572 -3.2227 0.0080 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3527 -2.2944 -2.0593 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8898 1.3222 1.9333 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2008 0.9338 1.7298 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4722 2.2138 -0.6236 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6920 2.8749 -0.9034 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2770 2.6009 0.4993 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0377 1.1850 -1.4752 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1265 3.9037 -0.0518 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1699 3.6252 1.3346 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4412 2.4877 -2.0263 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3693 4.2753 1.0595 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5345 1.9706 0.8489 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7948 0.8134 -2.5865 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9942 1.4635 -2.8616 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9229 -1.8039 0.5809 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3658 -2.3218 -0.4068 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7345 -2.0305 -0.7826 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8326 -1.8363 1.4505 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4561 -2.2895 -1.2763 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5541 -2.0951 0.9566 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5275 1.3806 0.5396 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2902 -1.5272 1.1085 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9952 -2.5983 -0.9318 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6470 -0.4340 0.5369 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0879 -3.5415 -0.3785 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7367 -1.5336 0.2101 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9932 -2.4391 -0.0546 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8823 0.6343 -1.3031 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0609 4.4256 -0.2474 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4054 3.9313 2.2054 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3819 2.9817 -2.2604 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7168 5.0728 1.7099 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4468 0.0185 -3.2398 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5831 1.1733 -3.7268 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5701 -2.0098 -1.4767 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9693 -1.6572 2.5136 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3266 -2.4697 -2.3402 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2789 -2.1002 1.6545 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7417 -0.3187 1.6215 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6466 -0.6454 0.1443 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1472 -3.8130 -1.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3792 -4.4344 0.1848 H 0 0 0 0 0 0 0 0 0 0 0 0 1 27 1 0 0 0 0 1 30 1 0 0 0 0 2 28 1 0 0 0 0 3 28 1 0 0 0 0 4 28 1 0 0 0 0 5 18 1 0 0 0 0 5 27 1 0 0 0 0 6 29 1 0 0 0 0 6 31 1 0 0 0 0 7 29 2 0 0 0 0 8 9 1 0 0 0 0 8 18 2 0 0 0 0 9 27 2 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 13 2 0 0 0 0 11 14 1 0 0 0 0 11 16 2 0 0 0 0 12 15 2 0 0 0 0 12 18 1 0 0 0 0 13 19 1 0 0 0 0 13 34 1 0 0 0 0 14 17 2 0 0 0 0 14 35 1 0 0 0 0 15 17 1 0 0 0 0 15 36 1 0 0 0 0 16 20 1 0 0 0 0 16 37 1 0 0 0 0 17 38 1 0 0 0 0 19 20 2 0 0 0 0 19 39 1 0 0 0 0 20 40 1 0 0 0 0 21 23 2 0 0 0 0 21 24 1 0 0 0 0 21 28 1 0 0 0 0 22 25 2 0 0 0 0 22 26 1 0 0 0 0 22 29 1 0 0 0 0 23 25 1 0 0 0 0 23 41 1 0 0 0 0 24 26 2 0 0 0 0 24 42 1 0 0 0 0 25 43 1 0 0 0 0 26 44 1 0 0 0 0 30 32 1 0 0 0 0 30 45 1 0 0 0 0 30 46 1 0 0 0 0 31 33 1 0 0 0 0 31 47 1 0 0 0 0 31 48 1 0 0 0 0 32 33 3 0 0 0 0 M END $$$$