@MOLECULE talampanel 44 47 0 0 0 SMALL GASTEIGER @ATOM 1 O -3.7987 -2.8721 0.1289 O.3 1 UNL1111111111 -0.3390 2 O -2.0253 -3.4469 -1.3164 O.3 1 UNL1111111111 -0.3332 3 O -1.5962 4.2708 -0.9867 O.2 1 UNL1111111111 -0.5369 4 N -0.6185 2.3999 -0.1984 N.am 1 UNL1111111111 -0.3942 5 N 0.6135 1.7734 -0.1136 N.2 1 UNL1111111111 -0.2383 6 N 5.7346 -1.9773 0.2339 N.pl3 1 UNL1111111111 -0.6371 7 C -1.4872 2.4577 1.0099 C.3 1 UNL1111111111 0.1302 8 C -1.4360 1.1506 1.8341 C.3 1 UNL1111111111 -0.3242 9 C -1.5768 -0.0645 0.9759 C.ar 1 UNL1111111111 0.0450 10 C -0.5269 -0.4079 0.1206 C.ar 1 UNL1111111111 -0.1002 11 C 0.6509 0.4784 0.0247 C.2 1 UNL1111111111 0.1919 12 C -1.1061 3.6353 1.9182 C.3 1 UNL1111111111 -0.4971 13 C -2.7448 -0.8480 1.0543 C.ar 1 UNL1111111111 -0.2227 14 C -0.5771 -1.5481 -0.7078 C.ar 1 UNL1111111111 -0.1549 15 C -2.7864 -1.9552 0.2420 C.ar 1 UNL1111111111 0.1588 16 C -1.7208 -2.2996 -0.6245 C.ar 1 UNL1111111111 0.1058 17 C 1.9803 -0.1483 0.0820 C.ar 1 UNL1111111111 -0.1553 18 C -0.6630 3.5018 -1.0828 C.2 1 UNL1111111111 0.6220 19 C -3.3451 -3.8214 -0.8644 C.3 1 UNL1111111111 0.1570 20 C 2.1919 -1.2562 0.9112 C.ar 1 UNL1111111111 -0.0305 21 C 3.0423 0.3605 -0.6754 C.ar 1 UNL1111111111 -0.0089 22 C 0.3663 3.5794 -2.1665 C.3 1 UNL1111111111 -0.5086 23 C 3.4374 -1.8581 0.9867 C.ar 1 UNL1111111111 -0.3122 24 C 4.2956 -0.2293 -0.6211 C.ar 1 UNL1111111111 -0.3218 25 C 4.5006 -1.3489 0.2112 C.ar 1 UNL1111111111 0.2971 26 H -2.5304 2.6063 0.6094 H 1 UNL1111111111 0.1663 27 H -2.2303 1.1958 2.6076 H 1 UNL1111111111 0.1624 28 H -0.4820 1.1011 2.4051 H 1 UNL1111111111 0.1692 29 H -1.2551 4.5934 1.3972 H 1 UNL1111111111 0.1759 30 H -1.7215 3.6615 2.8220 H 1 UNL1111111111 0.1512 31 H -0.0537 3.5909 2.2199 H 1 UNL1111111111 0.1579 32 H -3.5655 -0.5850 1.7134 H 1 UNL1111111111 0.1804 33 H 0.2463 -1.8017 -1.3714 H 1 UNL1111111111 0.1859 34 H -4.0268 -3.7571 -1.7239 H 1 UNL1111111111 0.1422 35 H -3.2681 -4.8028 -0.3774 H 1 UNL1111111111 0.1396 36 H 1.3654 -1.6500 1.5075 H 1 UNL1111111111 0.1568 37 H 2.8774 1.2330 -1.3128 H 1 UNL1111111111 0.1621 38 H 0.3421 2.6857 -2.8076 H 1 UNL1111111111 0.1806 39 H 1.3828 3.6484 -1.7468 H 1 UNL1111111111 0.1857 40 H 0.1934 4.4601 -2.8020 H 1 UNL1111111111 0.1766 41 H 3.5928 -2.7168 1.6303 H 1 UNL1111111111 0.1598 42 H 5.1116 0.1653 -1.2159 H 1 UNL1111111111 0.1580 43 H 6.5231 -1.5472 -0.1951 H 1 UNL1111111111 0.2982 44 H 5.9275 -2.6765 0.9157 H 1 UNL1111111111 0.2985 @BOND 1 1 15 1 2 1 19 1 3 2 16 1 4 2 19 1 5 3 18 2 6 4 5 1 7 4 7 1 8 4 18 am 9 5 11 2 10 6 25 1 11 6 43 1 12 6 44 1 13 7 8 1 14 7 12 1 15 7 26 1 16 8 9 1 17 8 27 1 18 8 28 1 19 9 10 ar 20 9 13 ar 21 10 11 1 22 10 14 ar 23 11 17 1 24 12 29 1 25 12 30 1 26 12 31 1 27 13 15 ar 28 13 32 1 29 14 16 ar 30 14 33 1 31 15 16 ar 32 17 20 ar 33 17 21 ar 34 18 22 1 35 19 34 1 36 19 35 1 37 20 23 ar 38 20 36 1 39 21 24 ar 40 21 37 1 41 22 38 1 42 22 39 1 43 22 40 1 44 23 25 ar 45 23 41 1 46 24 25 ar 47 24 42 1