B1IB7D -OEChem-04022106442D 50 54 0 1 0 0 0 0 0999 V2000 2.0000 -1.7589 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 10.6302 2.8717 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0304 0.7644 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6768 0.2264 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.2551 2.5398 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.3876 -2.5398 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.5754 -0.7351 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7684 0.4628 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.7402 0.2536 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.5754 -2.7351 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.9874 1.1769 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.9659 1.3831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2766 2.3336 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.3196 1.9212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6088 3.0779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6983 0.0201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3876 -0.9304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4414 -1.2351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4414 -2.2351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9712 -1.7351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8433 -0.7351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9355 -1.1402 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7093 -1.2351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2677 -0.3959 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7093 -2.2351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6249 -2.0907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2892 -0.6021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3649 1.3778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6464 -2.2970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9785 -1.5527 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4015 0.7154 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9865 0.7634 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5798 1.2958 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4692 2.9229 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7727 2.2132 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9370 1.4333 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1351 3.4056 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3775 3.6532 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0908 -0.2351 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4477 3.1292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6692 2.0784 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5912 -1.7351 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5802 -3.1292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1724 -2.5451 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0389 -2.5522 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8751 -0.1407 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9321 1.6280 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1146 1.9450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7976 1.1276 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4537 -2.8863 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 30 1 0 0 0 0 2 14 1 0 0 0 0 2 15 1 0 0 0 0 3 16 2 0 0 0 0 4 11 1 0 0 0 0 4 16 1 0 0 0 0 4 39 1 0 0 0 0 5 13 1 0 0 0 0 5 40 1 0 0 0 0 5 41 1 0 0 0 0 6 19 1 0 0 0 0 6 20 1 0 0 0 0 6 43 1 0 0 0 0 7 18 2 0 0 0 0 7 23 1 0 0 0 0 8 9 1 0 0 0 0 8 24 1 0 0 0 0 8 28 1 0 0 0 0 9 21 2 0 0 0 0 10 19 2 0 0 0 0 10 25 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 11 31 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 13 15 1 0 0 0 0 13 34 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 20 2 0 0 0 0 18 19 1 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 24 2 0 0 0 0 22 26 1 0 0 0 0 23 25 2 0 0 0 0 24 27 1 0 0 0 0 25 44 1 0 0 0 0 26 29 2 0 0 0 0 26 45 1 0 0 0 0 27 30 2 0 0 0 0 27 46 1 0 0 0 0 28 47 1 0 0 0 0 28 48 1 0 0 0 0 28 49 1 0 0 0 0 29 30 1 0 0 0 0 29 50 1 0 0 0 0 M END $$$$