B4QRG3 -OEChem-04022108462D 42 44 0 1 0 0 0 0 0999 V2000 2.8660 0.4720 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.5280 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2320 1.8380 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.7320 0.9720 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.7320 0.9720 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.5280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3660 2.3380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0981 2.3380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.0280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.0280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.0280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.0280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.5280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9641 1.8380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0981 3.3380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8301 2.3380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9641 3.8380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8301 3.3380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8925 0.3731 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8397 0.3614 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 1.1840 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 0.7820 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -0.2180 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6760 2.8750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8291 2.6480 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0560 1.8011 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7880 -0.4454 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3894 -1.1357 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3426 -1.1357 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9441 -0.4454 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3894 -1.9204 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7880 -2.6106 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9441 -2.6106 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3426 -1.9204 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -2.8380 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9641 1.2180 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5611 3.6480 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -3.8380 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -3.8380 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3671 2.0280 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9641 4.4580 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3671 3.6480 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 1 0 0 0 0 1 6 1 0 0 0 0 1 22 1 0 0 0 0 2 13 1 0 0 0 0 2 38 1 0 0 0 0 2 39 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 7 1 0 0 0 0 3 8 1 0 0 0 0 4 5 1 0 0 0 0 4 19 1 0 0 0 0 5 20 1 0 0 0 0 5 21 1 0 0 0 0 6 9 1 0 0 0 0 6 10 1 0 0 0 0 6 23 1 0 0 0 0 7 24 1 0 0 0 0 7 25 1 0 0 0 0 7 26 1 0 0 0 0 8 14 2 0 0 0 0 8 15 1 0 0 0 0 9 11 1 0 0 0 0 9 27 1 0 0 0 0 9 28 1 0 0 0 0 10 12 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 11 13 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 35 1 0 0 0 0 14 16 1 0 0 0 0 14 36 1 0 0 0 0 15 17 2 0 0 0 0 15 37 1 0 0 0 0 16 18 2 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 18 42 1 0 0 0 0 M END $$$$