EXO4161 -OEChem-04222010033D 53 56 0 1 0 0 0 0 0999 V2000 -0.9217 -2.5874 0.9632 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6887 -0.8285 -0.6128 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7833 -2.2213 -0.5048 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2308 -4.5254 -1.1582 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3979 -1.3581 1.7492 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9419 1.6615 0.0710 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6431 -2.3447 -0.6112 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2368 -2.5830 -0.3828 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6620 1.4022 0.5017 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2693 4.1758 -2.3800 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7742 3.3930 2.3177 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5850 4.6816 0.0041 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3576 -2.2243 -0.5132 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.8547 -3.6159 -0.1272 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.8288 -1.1633 0.4534 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.3284 -3.5986 0.0357 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.3106 -1.2603 0.5926 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.7946 -4.9277 0.5629 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5442 -0.2602 -0.3755 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7143 1.0533 -0.1383 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7357 -1.1425 -0.4023 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0342 -0.4932 -0.1658 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0691 0.8813 0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4117 2.0033 -0.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2162 -1.2381 -0.1678 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2884 1.5208 0.2835 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0722 2.2559 1.1015 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8175 2.6510 -1.2683 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4345 -0.5961 0.0575 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4708 0.7805 0.2827 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8830 3.5504 -1.2329 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1379 3.1553 1.1368 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5433 3.8026 -0.0305 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0495 -1.9851 -1.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3420 -3.9482 0.7969 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1383 -0.1715 0.1046 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8485 -3.4142 -0.9337 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0085 -0.6285 1.4371 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2135 -5.1528 1.5499 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0303 -5.7532 -0.1152 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2928 -4.8793 0.6867 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0749 -2.3835 0.4087 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7792 -4.2571 -1.9764 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0930 -0.6294 2.3163 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3192 2.5933 0.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7538 1.7578 2.0147 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3031 2.4551 -2.2068 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3604 -1.1667 0.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1539 -2.9040 -0.3427 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3745 0.7411 0.4665 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7001 3.8788 -3.1106 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3604 2.8559 3.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9171 4.7282 0.9174 H 0 0 0 0 0 0 0 0 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 2 17 1 0 0 0 0 2 19 1 0 0 0 0 3 13 1 0 0 0 0 3 42 1 0 0 0 0 4 14 1 0 0 0 0 4 43 1 0 0 0 0 5 15 1 0 0 0 0 5 44 1 0 0 0 0 6 20 1 0 0 0 0 6 23 1 0 0 0 0 7 21 2 0 0 0 0 8 25 1 0 0 0 0 8 49 1 0 0 0 0 9 30 1 0 0 0 0 9 50 1 0 0 0 0 10 31 1 0 0 0 0 10 51 1 0 0 0 0 11 32 1 0 0 0 0 11 52 1 0 0 0 0 12 33 1 0 0 0 0 12 53 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 34 1 0 0 0 0 14 16 1 0 0 0 0 14 35 1 0 0 0 0 15 17 1 0 0 0 0 15 36 1 0 0 0 0 16 18 1 0 0 0 0 16 37 1 0 0 0 0 17 38 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 25 2 0 0 0 0 23 26 2 0 0 0 0 24 27 2 0 0 0 0 24 28 1 0 0 0 0 25 29 1 0 0 0 0 26 30 1 0 0 0 0 26 45 1 0 0 0 0 27 32 1 0 0 0 0 27 46 1 0 0 0 0 28 31 2 0 0 0 0 28 47 1 0 0 0 0 29 30 2 0 0 0 0 29 48 1 0 0 0 0 31 33 1 0 0 0 0 32 33 2 0 0 0 0 M END $$$$