@MOLECULE FDBD00257 51 50 0 0 0 SMALL USER_CHARGES @ATOM 1 Cl 3.4808 2.2363 -1.7187 Cl 1 UNK -0.1227 2 O 5.7345 0.4369 0.7623 O.3 1 UNK -0.3705 3 N 4.4137 5.0536 -0.4497 N.4 1 UNK 0.2345 4 N1 7.7692 3.9545 0.7666 N.4 1 UNK 0.2345 5 N2 0.6994 4.7640 -0.2787 N.4 1 UNK 0.2345 6 N3 9.7362 1.3790 -1.1188 N.4 1 UNK 0.2223 7 N4 1.0030 1.1636 0.7012 N.4 1 UNK 0.2223 8 C 5.4600 1.5806 -0.0020 C.3 1 UNK 0.0954 9 C1 5.8946 1.6029 1.5243 C.3 1 UNK 0.0754 10 C2 3.9418 1.8249 -0.0641 C.3 1 UNK 0.0510 11 C3 5.4642 4.7695 0.5375 C.3 1 UNK 0.0076 12 C4 3.1012 5.0132 0.2096 C.3 1 UNK 0.0076 13 C5 6.7819 4.4626 -0.1966 C.3 1 UNK 0.0076 14 C6 1.9952 5.1558 -0.8525 C.3 1 UNK 0.0076 15 C7 8.9167 3.3822 0.0476 C.3 1 UNK 0.0075 16 C8 0.5189 3.3092 -0.3935 C.3 1 UNK 0.0075 17 C9 8.6038 1.9305 -0.3614 C.3 1 UNK 0.0057 18 C10 1.0231 2.6213 0.8887 C.3 1 UNK 0.0057 19 H 4.4442 4.3530 -1.1904 H 1 UNK 0.2018 20 H1 4.5649 5.9788 -0.8517 H 1 UNK 0.2018 21 H2 7.3381 3.2334 1.3451 H 1 UNK 0.2018 22 H3 8.0901 4.7220 1.3569 H 1 UNK 0.2018 23 H4 -0.0503 5.2383 -0.7820 H 1 UNK 0.2018 24 H5 0.6753 5.0281 0.7062 H 1 UNK 0.2018 25 H6 9.5284 0.4177 -1.3893 H 1 UNK 0.1996 26 H7 10.5741 1.3950 -0.5374 H 1 UNK 0.1996 27 H8 9.8920 1.9415 -1.9553 H 1 UNK 0.1996 28 H9 1.3368 0.7070 1.5500 H 1 UNK 0.1996 29 H10 1.6086 0.9129 -0.0804 H 1 UNK 0.1996 30 H11 0.0497 0.8593 0.5039 H 1 UNK 0.1996 31 H12 5.7888 1.9893 -0.9346 H 1 UNK 0.0631 32 H13 6.8692 1.9395 1.8102 H 1 UNK 0.0586 33 H14 5.5074 1.9962 2.4410 H 1 UNK 0.0586 34 H15 3.4249 0.9390 0.2407 H 1 UNK 0.0456 35 H16 3.6825 2.6310 0.5900 H 1 UNK 0.0456 36 H17 5.1796 3.9248 1.1294 H 1 UNK 0.0867 37 H18 5.5977 5.6193 1.1738 H 1 UNK 0.0867 38 H19 3.0287 5.8174 0.9117 H 1 UNK 0.0867 39 H20 2.9866 4.0823 0.7246 H 1 UNK 0.0867 40 H21 6.6068 3.7247 -0.9514 H 1 UNK 0.0867 41 H22 7.1539 5.3561 -0.6528 H 1 UNK 0.0867 42 H23 1.9457 6.1735 -1.1793 H 1 UNK 0.0867 43 H24 2.2199 4.5205 -1.6837 H 1 UNK 0.0867 44 H25 9.7769 3.3946 0.6839 H 1 UNK 0.0867 45 H26 9.1096 3.9631 -0.8300 H 1 UNK 0.0867 46 H27 1.0741 2.9470 -1.2334 H 1 UNK 0.0867 47 H28 -0.5198 3.0904 -0.5283 H 1 UNK 0.0867 48 H29 8.4405 1.3402 0.5160 H 1 UNK 0.0866 49 H30 7.7251 1.9138 -0.9717 H 1 UNK 0.0866 50 H31 2.0231 2.9408 1.0956 H 1 UNK 0.0866 51 H32 0.3884 2.8848 1.7088 H 1 UNK 0.0866 @BOND 1 10 1 1 2 8 2 1 3 9 2 1 4 3 11 1 5 12 3 1 6 13 4 1 7 4 15 1 8 5 14 1 9 16 5 1 10 17 6 1 11 18 7 1 12 8 9 1 13 8 10 1 14 11 13 1 15 14 12 1 16 15 17 1 17 16 18 1 18 3 19 1 19 3 20 1 20 4 21 1 21 4 22 1 22 5 23 1 23 5 24 1 24 6 25 1 25 6 26 1 26 6 27 1 27 7 28 1 28 7 29 1 29 7 30 1 30 8 31 1 31 9 32 1 32 9 33 1 33 10 34 1 34 10 35 1 35 11 36 1 36 11 37 1 37 12 38 1 38 12 39 1 39 13 40 1 40 13 41 1 41 14 42 1 42 14 43 1 43 15 44 1 44 15 45 1 45 16 46 1 46 16 47 1 47 17 48 1 48 17 49 1 49 18 50 1 50 18 51 1