LDMI17 -OEChem-05032300052D 63 67 0 0 0 0 0 0 0999 V2000 7.0444 -0.1770 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.5477 -1.0411 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5410 0.6871 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.8840 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.2405 -0.1570 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.7045 -0.1437 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.1007 1.3463 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5984 -2.3247 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.5672 2.0229 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.9084 0.3263 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.9725 -0.1503 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.1702 2.8223 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5984 -0.0777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3802 -0.7012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6235 -0.3002 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3802 -1.7012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1896 -1.2012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1803 -0.6804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2742 -0.1665 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2328 1.8430 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9648 1.8496 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8327 1.3530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6235 -2.1022 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2742 -2.2358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3687 1.3396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1803 -1.7220 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7764 -0.1704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6405 0.3330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1046 0.3463 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5465 1.8205 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8366 0.3530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1586 2.9291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5007 1.8363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3725 0.3396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6366 1.3330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5084 -0.1637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2114 2.5673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0832 0.3089 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3294 0.4809 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6235 0.3198 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0190 -0.1623 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7049 -0.8146 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7049 -1.5878 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2670 0.4534 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6294 2.3195 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8324 2.3164 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7364 -2.9291 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2670 -2.8558 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7160 -2.0341 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3797 -0.6468 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1767 -0.6438 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9060 0.9463 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3174 1.2443 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.0741 1.4949 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4665 3.4673 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4983 2.4563 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9106 0.0317 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0985 1.6409 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5108 -0.7837 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9749 -0.7703 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.6745 2.1551 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.6237 3.0304 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7484 2.9796 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 2 0 0 0 0 1 10 1 0 0 0 0 1 18 1 0 0 0 0 4 23 2 0 0 0 0 5 29 2 0 0 0 0 6 31 2 0 0 0 0 7 20 1 0 0 0 0 7 21 1 0 0 0 0 7 29 1 0 0 0 0 8 16 1 0 0 0 0 8 23 1 0 0 0 0 8 47 1 0 0 0 0 9 22 1 0 0 0 0 9 30 1 0 0 0 0 9 32 1 0 0 0 0 10 27 1 0 0 0 0 10 52 1 0 0 0 0 11 29 1 0 0 0 0 11 31 1 0 0 0 0 11 60 1 0 0 0 0 12 21 1 0 0 0 0 12 32 2 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 16 2 0 0 0 0 14 19 1 0 0 0 0 15 17 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 16 24 1 0 0 0 0 17 23 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 18 19 2 0 0 0 0 18 26 1 0 0 0 0 19 44 1 0 0 0 0 20 25 1 0 0 0 0 20 45 1 0 0 0 0 20 46 1 0 0 0 0 21 22 2 0 0 0 0 22 31 1 0 0 0 0 24 26 2 0 0 0 0 24 48 1 0 0 0 0 25 33 2 0 0 0 0 25 34 1 0 0 0 0 26 49 1 0 0 0 0 27 28 1 0 0 0 0 27 50 1 0 0 0 0 27 51 1 0 0 0 0 28 35 2 0 0 0 0 28 36 1 0 0 0 0 30 37 1 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 32 55 1 0 0 0 0 33 35 1 0 0 0 0 33 56 1 0 0 0 0 34 36 2 0 0 0 0 34 57 1 0 0 0 0 35 58 1 0 0 0 0 36 59 1 0 0 0 0 37 61 1 0 0 0 0 37 62 1 0 0 0 0 37 63 1 0 0 0 0 M END $$$$