L3M1RW -OEChem-05022323192D 51 50 0 1 0 0 0 0 0999 V2000 11.1972 1.0600 0.0000 P 0 0 3 0 0 0 0 0 0 0 0 0 10.3312 0.5600 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6972 1.9260 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6972 0.1940 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.6613 1.0600 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -0.4400 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.7953 2.5600 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -0.9400 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 -0.9400 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.6613 -1.9400 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 1.0600 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9292 -1.9400 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -0.4400 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0632 1.5600 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 1.0600 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 2.0600 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.9292 1.0600 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.9292 0.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 0.5600 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.4651 1.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 0.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 1.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7953 -0.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 1.0600 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.8671 0.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7953 1.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 -0.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7953 -1.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 0.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3923 0.7500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3187 0.1677 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7172 -0.5226 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 1.1800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0632 2.1800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8637 1.5350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0666 1.5350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7365 0.0851 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5335 0.0851 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3996 1.5350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6025 1.5350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4058 -0.5477 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0073 0.1426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8059 1.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 1.6800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8059 2.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0072 2.4630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1982 1.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -1.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6613 -2.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.7500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 1 4 2 0 0 0 0 1 14 1 0 0 0 0 2 20 1 0 0 0 0 3 47 1 0 0 0 0 5 26 1 0 0 0 0 5 48 1 0 0 0 0 6 25 2 0 0 0 0 7 26 2 0 0 0 0 8 27 1 0 0 0 0 8 49 1 0 0 0 0 9 27 2 0 0 0 0 10 28 1 0 0 0 0 10 50 1 0 0 0 0 11 29 1 0 0 0 0 11 51 1 0 0 0 0 12 28 2 0 0 0 0 13 29 2 0 0 0 0 17 14 1 6 0 0 0 14 34 1 0 0 0 0 19 15 1 1 0 0 0 15 25 1 0 0 0 0 15 44 1 0 0 0 0 24 16 1 1 0 0 0 16 45 1 0 0 0 0 16 46 1 0 0 0 0 17 18 1 0 0 0 0 17 26 1 0 0 0 0 17 30 1 0 0 0 0 18 23 1 0 0 0 0 18 31 1 0 0 0 0 18 32 1 0 0 0 0 19 20 1 0 0 0 0 19 27 1 0 0 0 0 19 33 1 0 0 0 0 20 35 1 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 21 24 1 0 0 0 0 21 37 1 0 0 0 0 21 38 1 0 0 0 0 22 25 1 0 0 0 0 22 39 1 0 0 0 0 22 40 1 0 0 0 0 23 28 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 24 29 1 0 0 0 0 24 43 1 0 0 0 0 M END $$$$