L98PTL -OEChem-05022323313D 54 57 0 0 0 0 0 0 0999 V2000 7.9473 -2.0354 -1.8076 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7296 0.0401 -2.0042 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.2733 -1.8955 2.0229 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.9149 -3.6892 1.7011 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4135 0.4326 1.8246 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4057 1.6067 -1.6670 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2804 0.4124 1.1086 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8401 1.6402 2.2192 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9367 2.4859 1.7391 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1307 -0.7723 2.1511 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4669 0.8551 -2.2977 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1483 -1.1091 1.0949 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8791 2.2871 0.4227 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1401 2.0085 -0.8744 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1867 -0.0288 -1.3206 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0296 1.4578 -0.2347 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0217 1.7205 1.0827 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0887 1.1449 -1.5596 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6774 3.6672 0.4403 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3417 3.3886 -0.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4387 -0.6093 1.2047 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7834 -1.9155 0.0255 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7410 -1.3286 -1.1113 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2917 0.4618 -0.6348 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4330 4.2179 -0.1996 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3823 -0.9219 0.2262 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7270 -2.2281 -0.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0264 -1.7312 -0.8526 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5194 -1.6648 0.4891 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4097 -2.1494 -0.2032 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9604 -0.3592 0.2732 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2173 -2.5215 1.4347 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5165 -2.8678 -2.8834 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4022 -1.5832 2.2705 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6075 -0.6333 3.1289 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0527 0.2589 -3.1195 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1586 1.5766 -2.7473 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1116 0.3793 -0.2521 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6763 2.4781 -1.2238 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3685 4.3393 0.9429 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1747 3.8620 -1.3682 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7262 0.0225 2.0404 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7734 -2.3064 -0.0617 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8806 -1.7198 -1.6465 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6421 1.4778 -0.7942 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5859 5.2933 -0.1919 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3930 -0.5316 0.3096 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3834 -2.8613 -1.7639 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0508 -3.1639 -0.0501 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8194 0.0585 0.7907 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2211 -3.8615 -2.5299 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7298 -2.3866 -3.4743 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3753 -3.0073 -3.5481 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7366 -2.4813 2.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 1 28 1 0 0 0 0 1 33 1 0 0 0 0 2 18 2 0 0 0 0 3 32 1 0 0 0 0 3 54 1 0 0 0 0 4 32 2 0 0 0 0 5 7 1 0 0 0 0 5 8 1 0 0 0 0 5 10 1 0 0 0 0 6 11 1 0 0 0 0 6 18 1 0 0 0 0 6 39 1 0 0 0 0 7 17 2 0 0 0 0 8 9 2 0 0 0 0 9 17 1 0 0 0 0 10 12 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 15 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 21 2 0 0 0 0 12 22 1 0 0 0 0 13 16 2 0 0 0 0 13 17 1 0 0 0 0 13 19 1 0 0 0 0 14 16 1 0 0 0 0 14 18 1 0 0 0 0 14 20 2 0 0 0 0 15 23 2 0 0 0 0 15 24 1 0 0 0 0 16 38 1 0 0 0 0 19 25 2 0 0 0 0 19 40 1 0 0 0 0 20 25 1 0 0 0 0 20 41 1 0 0 0 0 21 26 1 0 0 0 0 21 42 1 0 0 0 0 22 27 2 0 0 0 0 22 43 1 0 0 0 0 23 30 1 0 0 0 0 23 44 1 0 0 0 0 24 31 2 0 0 0 0 24 45 1 0 0 0 0 25 46 1 0 0 0 0 26 28 2 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 29 32 1 0 0 0 0 30 49 1 0 0 0 0 31 50 1 0 0 0 0 33 51 1 0 0 0 0 33 52 1 0 0 0 0 33 53 1 0 0 0 0 M END $$$$