@MOLECULE ambrisentan 50 52 0 0 0 SMALL GASTEIGER @ATOM 1 O -2.2324 0.4612 -1.7328 O.3 1 UNL1111111111 -0.3720 2 O 0.6993 0.0922 0.2883 O.3 1 UNL1111111111 -0.2340 3 O 0.1439 1.7143 -2.8233 O.3 1 UNL1111111111 -0.5545 4 O 0.6995 2.6144 -0.8585 O.2 1 UNL1111111111 -0.4610 5 N 2.7096 -0.1230 -0.9108 N.ar 1 UNL1111111111 -0.5577 6 N 2.5594 -0.2628 1.5092 N.ar 1 UNL1111111111 -0.4805 7 C -1.4557 0.0471 -0.6235 C.3 1 UNL1111111111 0.2329 8 C 0.0518 0.2528 -0.9797 C.3 1 UNL1111111111 -0.0297 9 C -1.8496 0.9853 0.4995 C.ar 1 UNL1111111111 -0.0563 10 C -1.8068 -1.3756 -0.2453 C.ar 1 UNL1111111111 -0.0632 11 C -1.4265 0.7072 1.8010 C.ar 1 UNL1111111111 -0.1153 12 C -3.1698 -1.6848 -0.1656 C.ar 1 UNL1111111111 -0.1279 13 C -2.6216 2.1172 0.2395 C.ar 1 UNL1111111111 -0.1232 14 C -0.8603 -2.3539 0.0461 C.ar 1 UNL1111111111 -0.1376 15 C 0.3303 1.6579 -1.4780 C.2 1 UNL1111111111 0.6219 16 C -2.1029 -0.3184 -2.9093 C.3 1 UNL1111111111 -0.2040 17 C -1.7699 1.5682 2.8396 C.ar 1 UNL1111111111 -0.1460 18 C -3.5796 -2.9629 0.1975 C.ar 1 UNL1111111111 -0.1589 19 C -2.9713 2.9707 1.2843 C.ar 1 UNL1111111111 -0.1599 20 C -1.2735 -3.6354 0.4128 C.ar 1 UNL1111111111 -0.1482 21 C -2.5443 2.6986 2.5824 C.ar 1 UNL1111111111 -0.1359 22 C -2.6291 -3.9420 0.4880 C.ar 1 UNL1111111111 -0.1449 23 C 2.0353 -0.0956 0.2663 C.ar 1 UNL1111111111 0.5116 24 C 4.0504 -0.2922 -0.8344 C.ar 1 UNL1111111111 0.3420 25 C 3.8988 -0.4291 1.5661 C.ar 1 UNL1111111111 0.3305 26 C 4.6895 -0.4439 0.4040 C.ar 1 UNL1111111111 -0.4525 27 C 4.8026 -0.3000 -2.1183 C.3 1 UNL1111111111 -0.4649 28 C 4.4931 -0.5926 2.9214 C.3 1 UNL1111111111 -0.4632 29 H 0.4098 -0.5080 -1.7140 H 1 UNL1111111111 0.1916 30 H -0.8195 -0.1773 2.0082 H 1 UNL1111111111 0.1695 31 H -3.9091 -0.9126 -0.3860 H 1 UNL1111111111 0.1657 32 H -2.9516 2.3426 -0.7750 H 1 UNL1111111111 0.1635 33 H 0.2064 -2.1386 0.0067 H 1 UNL1111111111 0.1602 34 H -2.2404 -1.3859 -2.7171 H 1 UNL1111111111 0.1300 35 H -1.1400 -0.1221 -3.3941 H 1 UNL1111111111 0.1446 36 H -2.9226 0.0633 -3.5316 H 1 UNL1111111111 0.1449 37 H -1.4264 1.3581 3.8508 H 1 UNL1111111111 0.1503 38 H -4.6399 -3.1977 0.2603 H 1 UNL1111111111 0.1486 39 H -3.5721 3.8540 1.0823 H 1 UNL1111111111 0.1456 40 H -0.5298 -4.3947 0.6455 H 1 UNL1111111111 0.1480 41 H -2.8104 3.3710 3.3943 H 1 UNL1111111111 0.1425 42 H -2.9482 -4.9406 0.7763 H 1 UNL1111111111 0.1449 43 H 0.3082 2.6135 -3.1999 H 1 UNL1111111111 0.3530 44 H 5.7621 -0.5672 0.4655 H 1 UNL1111111111 0.1844 45 H 5.4409 -1.1904 -2.2110 H 1 UNL1111111111 0.1688 46 H 4.1289 -0.2829 -2.9931 H 1 UNL1111111111 0.1860 47 H 5.4532 0.5858 -2.1992 H 1 UNL1111111111 0.1766 48 H 5.1541 0.2534 3.1680 H 1 UNL1111111111 0.1757 49 H 3.7185 -0.6353 3.7090 H 1 UNL1111111111 0.1899 50 H 5.0880 -1.5142 2.9949 H 1 UNL1111111111 0.1684 @BOND 1 1 7 1 2 1 16 1 3 2 8 1 4 2 23 1 5 3 15 1 6 3 43 1 7 4 15 2 8 5 23 ar 9 5 24 ar 10 6 23 ar 11 6 25 ar 12 7 8 1 13 7 9 1 14 7 10 1 15 8 15 1 16 8 29 1 17 9 11 ar 18 9 13 ar 19 10 12 ar 20 10 14 ar 21 11 17 ar 22 11 30 1 23 12 18 ar 24 12 31 1 25 13 19 ar 26 13 32 1 27 14 20 ar 28 14 33 1 29 16 34 1 30 16 35 1 31 16 36 1 32 17 21 ar 33 17 37 1 34 18 22 ar 35 18 38 1 36 19 21 ar 37 19 39 1 38 20 22 ar 39 20 40 1 40 21 41 1 41 22 42 1 42 24 26 ar 43 24 27 1 44 25 26 ar 45 25 28 1 46 26 44 1 47 27 45 1 48 27 46 1 49 27 47 1 50 28 48 1 51 28 49 1 52 28 50 1