B6R1JK -OEChem-04022112323D 31 31 0 1 0 0 0 0 0999 V2000 0.3911 -2.1342 0.4097 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4946 -0.1520 -0.0339 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5043 -1.5586 -1.3736 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7622 0.2971 0.2763 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.8359 -0.4352 -0.7240 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.9630 0.9256 -0.4658 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3974 -0.9962 -0.0625 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2218 -0.5964 1.4377 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7582 -0.5549 0.5722 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5559 1.2039 -0.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8802 1.7409 0.4359 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6169 0.6443 0.3698 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9533 1.6158 -0.2648 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1887 1.1166 0.7282 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5590 0.2557 -1.5247 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5736 0.1541 -0.9478 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5879 1.5810 -1.2615 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8678 -1.4087 1.0892 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3724 -1.0373 1.9676 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7785 -0.0212 2.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1441 -1.4386 0.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.7818 1.6303 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8217 1.8436 -0.0825 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3840 1.1821 -1.6565 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8718 -1.9920 -2.0463 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2987 -1.2292 -1.9191 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3141 2.4836 1.0066 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6208 2.2736 -0.1697 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4300 1.1048 1.1356 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6441 0.7164 0.6953 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3730 2.5776 -0.5205 H 0 0 0 0 0 0 0 0 0 0 0 0 1 7 2 0 0 0 0 2 7 1 0 0 0 0 2 9 1 0 0 0 0 2 10 1 0 0 0 0 3 5 1 0 0 0 0 3 25 1 0 0 0 0 3 26 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 8 1 0 0 0 0 4 14 1 0 0 0 0 5 7 1 0 0 0 0 5 15 1 0 0 0 0 6 11 1 0 0 0 0 6 16 1 0 0 0 0 6 17 1 0 0 0 0 8 18 1 0 0 0 0 8 19 1 0 0 0 0 8 20 1 0 0 0 0 9 12 1 0 0 0 0 9 21 1 0 0 0 0 9 22 1 0 0 0 0 10 13 1 0 0 0 0 10 23 1 0 0 0 0 10 24 1 0 0 0 0 11 27 1 0 0 0 0 11 28 1 0 0 0 0 11 29 1 0 0 0 0 12 13 2 0 0 0 0 12 30 1 0 0 0 0 13 31 1 0 0 0 0 M END $$$$