@MOLECULE ellsyl 30 32 0 0 0 SMALL GASTEIGER @ATOM 1 S -1.7532 1.9191 -0.6230 S.2 1 UNL1111111111 0.1475 2 N 2.0695 -1.5208 -0.2296 N.pl3 1 UNL1111111111 -0.5700 3 N 3.3174 0.3520 0.2620 N.2 1 UNL1111111111 -0.4797 4 C -0.0390 0.5298 0.7441 C.ar 1 UNL1111111111 -0.1109 5 C 1.1718 0.0906 1.4898 C.3 1 UNL1111111111 -0.2755 6 C 2.2223 -0.3065 0.5027 C.2 1 UNL1111111111 0.3526 7 C -1.1371 -0.3737 0.4543 C.ar 1 UNL1111111111 -0.0300 8 C -0.2096 1.7789 0.2336 C.ar 1 UNL1111111111 -0.0381 9 C 3.1915 -1.5650 -1.2081 C.3 1 UNL1111111111 -0.1293 10 C 4.0660 -0.3276 -0.8108 C.3 1 UNL1111111111 -0.1248 11 C -2.1603 0.2414 -0.2959 C.ar 1 UNL1111111111 -0.1292 12 C -1.2630 -1.7185 0.8138 C.ar 1 UNL1111111111 -0.1537 13 C 0.7159 2.9165 0.3251 C.3 1 UNL1111111111 -0.4482 14 C -3.2965 -0.4578 -0.6881 C.ar 1 UNL1111111111 -0.1302 15 C -2.3946 -2.4196 0.4202 C.ar 1 UNL1111111111 -0.1373 16 C -3.4050 -1.7950 -0.3251 C.ar 1 UNL1111111111 -0.1472 17 H 1.5558 0.9088 2.1473 H 1 UNL1111111111 0.1899 18 H 0.9511 -0.7526 2.1829 H 1 UNL1111111111 0.1795 19 H 2.8432 -1.5123 -2.2527 H 1 UNL1111111111 0.1300 20 H 3.7377 -2.5173 -1.0669 H 1 UNL1111111111 0.1516 21 H 5.0605 -0.6281 -0.4300 H 1 UNL1111111111 0.1529 22 H 4.2228 0.3731 -1.6513 H 1 UNL1111111111 0.1468 23 H 1.1530 -1.7545 -0.5799 H 1 UNL1111111111 0.2976 24 H -0.4840 -2.2075 1.3964 H 1 UNL1111111111 0.1615 25 H 0.5758 3.6759 -0.4581 H 1 UNL1111111111 0.1654 26 H 0.6271 3.4337 1.2964 H 1 UNL1111111111 0.1723 27 H 1.7721 2.5836 0.2453 H 1 UNL1111111111 0.1913 28 H -4.0844 0.0229 -1.2654 H 1 UNL1111111111 0.1597 29 H -2.5035 -3.4685 0.6930 H 1 UNL1111111111 0.1536 30 H -4.2829 -2.3671 -0.6203 H 1 UNL1111111111 0.1522 @BOND 1 1 8 ar 2 1 11 ar 3 2 6 1 4 2 9 1 5 2 23 1 6 3 6 2 7 3 10 1 8 4 5 1 9 4 7 ar 10 4 8 ar 11 5 6 1 12 5 17 1 13 5 18 1 14 7 11 ar 15 7 12 ar 16 8 13 1 17 9 10 1 18 9 19 1 19 9 20 1 20 10 21 1 21 10 22 1 22 11 14 ar 23 12 15 ar 24 12 24 1 25 13 25 1 26 13 26 1 27 13 27 1 28 14 16 ar 29 14 28 1 30 15 16 ar 31 15 29 1 32 16 30 1