@MOLECULE 68943792 31 34 1 SMALL USER_CHARGES @ATOM 1 N1 -0.8393 -1.3241 0.1844 N.3 1 noname -0.3154 2 C1 1.2178 -0.0552 0.5697 C.3 1 noname 0.0310 3 C2 0.7236 0.2532 -0.8451 C.3 1 noname -0.0170 4 C3 0.4737 1.2515 0.2871 C.3 1 noname -0.0370 5 C4 0.2660 -1.0501 1.2369 C.3 1 noname 0.0053 6 C5 -0.5577 -0.5362 -1.1211 C.3 1 noname -0.0010 7 C6 2.5002 0.3370 1.1471 C.2 1 noname -0.0480 8 C7 3.6859 -0.0937 0.5634 C.2 1 noname -0.0450 9 C8 2.5353 1.1409 2.2804 C.2 1 noname -0.0542 10 C9 4.9068 0.2797 1.1130 C.2 1 noname -0.0405 11 C10 3.7562 1.5142 2.8301 C.2 1 noname -0.0471 12 C11 4.9420 1.0836 2.2464 C.2 1 noname -0.0441 13 C12 6.0925 -0.1510 0.5293 C.2 1 noname -0.0475 14 C13 6.1629 1.4569 2.7961 C.2 1 noname -0.0484 15 C14 7.3134 0.2223 1.0790 C.2 1 noname -0.0569 16 C15 7.3486 1.0263 2.2124 C.2 1 noname -0.0570 17 H1 1.1691 0.9088 -1.5932 H 1 noname 0.0325 18 H2 -0.5578 1.1633 0.6282 H 1 noname 0.0280 19 H3 1.0646 2.1674 0.2803 H 1 noname 0.0280 20 H4 -0.1788 -0.5912 2.1199 H 1 noname 0.0437 21 H5 0.8099 -1.9689 1.4561 H 1 noname 0.0437 22 H6 -1.3774 0.1567 -1.3113 H 1 noname 0.0431 23 H7 -0.3780 -1.2278 -1.9441 H 1 noname 0.0431 24 H8 -0.8727 -2.3245 -0.0219 H 1 noname 0.1222 25 H9 3.6601 -0.6836 -0.2683 H 1 noname 0.0632 26 H10 1.6652 1.4569 2.7088 H 1 noname 0.0625 27 H11 3.7820 2.1041 3.6618 H 1 noname 0.0629 28 H12 6.0667 -0.7409 -0.3024 H 1 noname 0.0629 29 H13 6.1887 2.0468 3.6278 H 1 noname 0.0629 30 H14 8.1835 -0.0936 0.6507 H 1 noname 0.0622 31 H15 8.2445 1.3002 2.6158 H 1 noname 0.0622 @BOND 1 1 5 1 2 1 6 1 3 1 24 1 4 2 3 1 5 2 4 1 6 2 5 1 7 2 7 1 8 3 4 1 9 3 6 1 10 3 17 1 11 4 18 1 12 4 19 1 13 5 20 1 14 5 21 1 15 6 22 1 16 6 23 1 17 7 8 2 18 7 9 1 19 8 10 1 20 8 25 1 21 9 11 2 22 9 26 1 23 10 12 1 24 10 13 2 25 11 12 1 26 11 27 1 27 12 14 2 28 13 15 1 29 13 28 1 30 14 16 1 31 14 29 1 32 15 16 2 33 15 30 1 34 16 31 1 @SUBSTRUCTURE 1 noname 1