BEJ3K7 -OEChem-04012114403D 37 41 0 0 0 0 0 0 0999 V2000 3.8158 1.8625 0.0030 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7213 2.9956 -0.0037 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8024 2.3025 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6940 -2.3292 -0.0024 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5753 2.9956 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2946 -0.1293 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4155 0.9603 -0.0009 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6870 -1.3950 -0.0018 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7140 -0.3414 -0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9663 0.7740 -0.0006 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5517 -0.4721 -0.0008 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9259 -1.7228 -0.0008 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7121 -1.5892 -0.0016 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6652 2.4011 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6050 2.0888 0.0003 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8511 0.4962 0.0017 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9852 -0.6632 -0.0002 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2015 -2.3014 -0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1337 -0.0669 0.0024 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3045 -1.4467 0.0013 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6766 -0.7559 1.2083 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6781 -0.7545 -1.2078 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0593 -0.9399 1.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0609 -0.9383 -1.2069 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7514 -1.0310 0.0016 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1163 -2.5986 -0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5473 -3.3291 -0.0032 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7140 4.0000 0.0001 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3323 -3.3785 -0.0009 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0189 0.5653 0.0037 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3071 -1.8659 0.0019 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1526 -0.6859 2.1586 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1554 -0.6835 -2.1588 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7198 2.2203 0.0042 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5971 -1.0117 2.1498 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6001 -1.0090 -2.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8280 -1.1740 0.0022 H 0 0 0 0 0 0 0 0 0 0 0 0 1 16 1 0 0 0 0 1 34 1 0 0 0 0 2 14 2 0 0 0 0 3 15 2 0 0 0 0 4 8 1 0 0 0 0 4 12 1 0 0 0 0 4 27 1 0 0 0 0 5 14 1 0 0 0 0 5 15 1 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 6 8 2 0 0 0 0 6 9 1 0 0 0 0 7 10 2 0 0 0 0 7 14 1 0 0 0 0 8 13 1 0 0 0 0 9 12 2 0 0 0 0 9 16 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 11 13 2 0 0 0 0 11 17 1 0 0 0 0 12 18 1 0 0 0 0 13 26 1 0 0 0 0 16 19 2 0 0 0 0 17 21 2 0 0 0 0 17 22 1 0 0 0 0 18 20 2 0 0 0 0 18 29 1 0 0 0 0 19 20 1 0 0 0 0 19 30 1 0 0 0 0 20 31 1 0 0 0 0 21 23 1 0 0 0 0 21 32 1 0 0 0 0 22 24 2 0 0 0 0 22 33 1 0 0 0 0 23 25 2 0 0 0 0 23 35 1 0 0 0 0 24 25 1 0 0 0 0 24 36 1 0 0 0 0 25 37 1 0 0 0 0 M END $$$$