L50RKD -OEChem-05022323132D 42 44 0 0 0 0 0 0 0999 V2000 3.4782 -1.4365 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.5109 1.5580 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 -0.4420 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 -0.4420 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.7784 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 1.0580 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.6448 1.0580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 0.0580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5827 -0.4420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6448 0.0580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7788 1.5580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4487 0.0580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7788 -0.4420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 1.0580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6691 -0.0353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 0.0580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 -1.6444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3769 1.0580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5109 2.5580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4487 1.0580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4612 0.9429 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 1.5580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0933 -2.5580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1818 -0.2520 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7788 2.1780 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7788 -1.0620 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3759 1.3680 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 -1.0620 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0669 0.5211 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9138 0.7480 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6869 1.5949 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1309 2.5580 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5109 3.1780 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8909 2.5580 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9118 1.3680 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0677 1.0718 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3323 1.5493 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8548 0.8140 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 2.1780 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5269 -2.3058 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8411 -3.1244 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6597 -2.8102 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 9 1 0 0 0 0 1 17 1 0 0 0 0 2 7 1 0 0 0 0 2 18 1 0 0 0 0 2 19 1 0 0 0 0 3 8 1 0 0 0 0 3 16 1 0 0 0 0 3 28 1 0 0 0 0 4 12 2 0 0 0 0 4 16 1 0 0 0 0 5 15 1 0 0 0 0 5 17 2 0 0 0 0 6 16 2 0 0 0 0 6 22 1 0 0 0 0 7 10 2 0 0 0 0 7 11 1 0 0 0 0 8 13 2 0 0 0 0 8 14 1 0 0 0 0 9 12 1 0 0 0 0 9 15 2 0 0 0 0 10 13 1 0 0 0 0 10 24 1 0 0 0 0 11 14 2 0 0 0 0 11 25 1 0 0 0 0 12 20 1 0 0 0 0 13 26 1 0 0 0 0 14 27 1 0 0 0 0 15 21 1 0 0 0 0 17 23 1 0 0 0 0 18 29 1 0 0 0 0 18 30 1 0 0 0 0 18 31 1 0 0 0 0 19 32 1 0 0 0 0 19 33 1 0 0 0 0 19 34 1 0 0 0 0 20 22 2 0 0 0 0 20 35 1 0 0 0 0 21 36 1 0 0 0 0 21 37 1 0 0 0 0 21 38 1 0 0 0 0 22 39 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 M END $$$$