L97PUR -OEChem-05022321442D 30 30 0 1 0 0 0 0 0999 V2000 3.7320 -3.4125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2320 3.1856 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7320 2.3195 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2320 1.4535 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.5875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2320 1.4535 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8660 -0.9125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.9125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.9125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.9125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.3195 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3335 1.0624 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3309 0.4270 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5420 1.9905 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -2.2225 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -2.2225 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 0.1244 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -0.1025 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -0.9494 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7741 -0.9494 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -0.1025 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1541 0.1244 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5420 1.9905 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5420 0.9166 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 -3.7225 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9220 3.7225 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 1 0 0 0 0 1 29 1 0 0 0 0 2 15 1 0 0 0 0 2 30 1 0 0 0 0 3 15 2 0 0 0 0 7 4 1 1 0 0 0 4 27 1 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 8 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 16 1 0 0 0 0 6 17 1 0 0 0 0 7 15 1 0 0 0 0 7 18 1 0 0 0 0 8 10 1 0 0 0 0 8 13 1 0 0 0 0 9 11 2 0 0 0 0 9 14 1 0 0 0 0 10 12 2 0 0 0 0 10 19 1 0 0 0 0 11 12 1 0 0 0 0 11 20 1 0 0 0 0 13 21 1 0 0 0 0 13 22 1 0 0 0 0 13 23 1 0 0 0 0 14 24 1 0 0 0 0 14 25 1 0 0 0 0 14 26 1 0 0 0 0 M END $$$$