mcule 29032413452D 20 21 0 0 0 0 0 0 0 0999 V2000 -0.0167 0.4916 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8793 -0.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0167 1.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8793 1.9916 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7418 0.4916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7418 1.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8793 -1.0083 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.7418 -2.5126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8625 2.0000 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.5999 2.0041 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5874 3.0125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8793 -3.0083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7418 -1.5083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7375 1.4999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4667 1.5166 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6042 -3.0083 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6042 -0.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6042 1.9916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4708 0.4916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4708 1.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2 1 2 0 0 0 0 3 1 1 0 0 0 0 4 3 2 0 0 0 0 5 2 1 0 0 0 0 6 4 1 0 0 0 0 7 2 1 0 0 0 0 8 13 1 0 0 0 0 9 3 1 0 0 0 0 10 14 1 0 0 0 0 11 10 2 0 0 0 0 12 8 2 0 0 0 0 13 7 1 0 0 0 0 14 9 1 0 0 0 0 15 10 1 0 0 0 0 16 8 1 0 0 0 0 17 5 2 0 0 0 0 18 6 2 0 0 0 0 19 17 1 0 0 0 0 20 18 1 0 0 0 0 5 6 1 0 0 0 0 19 20 2 0 0 0 0 M END > P-18931599 $$$$