B3PI0A -OEChem-04022118443D 57 60 0 0 0 0 0 0 0999 V2000 2.6916 0.6403 1.0691 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0508 2.4253 0.1247 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5651 0.1459 0.0410 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3513 0.8532 1.3683 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9969 0.3052 -0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0785 -1.2125 0.0392 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5373 1.0075 1.2064 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3794 1.0620 -1.3163 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4530 -1.9148 -1.2682 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6068 -1.9791 1.2546 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0440 1.2350 1.1155 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8862 1.2911 -1.4037 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9959 -3.3712 -1.2755 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1479 -3.4349 1.2438 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4232 1.9877 -0.1567 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5204 -4.1324 -0.0613 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2671 0.4501 -0.7875 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6976 1.2466 0.1189 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8906 -0.9041 -0.3902 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2478 1.5238 -0.2833 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1092 -0.5658 0.4606 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5594 0.7821 -0.0746 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8596 0.6658 -0.2778 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7519 1.0009 0.1835 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6546 0.8922 -0.8885 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4977 -0.6667 -0.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0117 -1.2427 0.1062 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3156 0.4110 2.0997 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0590 1.9797 1.3652 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8873 2.0387 -1.3726 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0476 0.5041 -2.2004 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5327 -1.9074 -1.4517 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9961 -1.3885 -2.1157 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7008 -1.9779 1.3054 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2583 -1.4970 2.1765 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3863 1.7964 1.9922 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5608 0.2676 1.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1175 1.8920 -2.2905 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3945 0.3273 -1.5307 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3373 -3.8612 -2.1943 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1005 -3.4088 -1.2835 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0603 -3.4753 1.3813 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5953 -3.9698 2.0891 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5136 2.0739 -0.2231 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0239 3.0083 -0.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1180 -5.1515 -0.0628 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6119 -4.2192 -0.1294 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2307 0.4956 -1.8845 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2157 -1.4305 -1.2963 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2005 -1.5672 0.1419 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9184 1.9615 0.6671 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3553 2.3449 -0.9998 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8909 -1.3272 0.3868 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8175 -0.4758 1.5137 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2261 1.3042 0.6174 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0824 0.6580 -1.0301 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4598 0.9661 -1.9482 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 1 0 0 0 0 1 23 1 0 0 0 0 2 18 2 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 3 18 1 0 0 0 0 4 24 2 0 0 0 0 5 7 1 0 0 0 0 5 8 1 0 0 0 0 5 26 1 0 0 0 0 6 9 1 0 0 0 0 6 10 1 0 0 0 0 6 27 1 0 0 0 0 7 11 1 0 0 0 0 7 28 1 0 0 0 0 7 29 1 0 0 0 0 8 12 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 9 13 1 0 0 0 0 9 32 1 0 0 0 0 9 33 1 0 0 0 0 10 14 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 15 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 13 16 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 16 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 15 44 1 0 0 0 0 15 45 1 0 0 0 0 16 46 1 0 0 0 0 16 47 1 0 0 0 0 17 19 1 0 0 0 0 17 20 1 0 0 0 0 17 23 1 0 0 0 0 17 48 1 0 0 0 0 18 24 1 0 0 0 0 19 21 1 0 0 0 0 19 49 1 0 0 0 0 19 50 1 0 0 0 0 20 22 1 0 0 0 0 20 51 1 0 0 0 0 20 52 1 0 0 0 0 21 22 1 0 0 0 0 21 53 1 0 0 0 0 21 54 1 0 0 0 0 22 55 1 0 0 0 0 22 56 1 0 0 0 0 23 25 2 0 0 0 0 24 25 1 0 0 0 0 25 57 1 0 0 0 0 M END $$$$