@MOLECULE pmdta 35 34 0 0 0 SMALL GASTEIGER @ATOM 1 N -0.0056 0.8362 -0.0154 N.3 1 UNL1111111111 -0.4341 2 N 3.5276 -0.3548 -0.1837 N.3 1 UNL1111111111 -0.3983 3 N -3.4999 -0.4439 -0.1825 N.3 1 UNL1111111111 -0.3983 4 C 1.2248 0.3158 -0.6568 C.3 1 UNL1111111111 -0.1158 5 C -1.2291 0.3116 -0.6658 C.3 1 UNL1111111111 -0.1145 6 C 2.3090 0.2058 0.4481 C.3 1 UNL1111111111 -0.1260 7 C -2.3765 0.3451 0.3789 C.3 1 UNL1111111111 -0.1274 8 C -0.0067 2.3148 0.0023 C.3 1 UNL1111111111 -0.2724 9 C 3.5058 -1.8336 -0.1622 C.3 1 UNL1111111111 -0.2790 10 C 4.7494 0.1492 0.4789 C.3 1 UNL1111111111 -0.2787 11 C -4.8046 0.1070 0.2408 C.3 1 UNL1111111111 -0.2785 12 C -3.3945 -1.8679 0.2022 C.3 1 UNL1111111111 -0.2785 13 H 1.5963 0.9502 -1.4879 H 1 UNL1111111111 0.1324 14 H 1.0417 -0.6883 -1.0924 H 1 UNL1111111111 0.1364 15 H -1.0630 -0.7380 -0.9900 H 1 UNL1111111111 0.1417 16 H -1.5278 0.8738 -1.5734 H 1 UNL1111111111 0.1271 17 H 1.9248 -0.4012 1.2933 H 1 UNL1111111111 0.1328 18 H 2.5182 1.2140 0.8606 H 1 UNL1111111111 0.1350 19 H -2.6890 1.3937 0.5542 H 1 UNL1111111111 0.1309 20 H -2.0074 -0.0394 1.3527 H 1 UNL1111111111 0.1369 21 H -0.8694 2.6665 0.5910 H 1 UNL1111111111 0.1419 22 H -0.0521 2.7793 -0.9945 H 1 UNL1111111111 0.1204 23 H 0.9027 2.6737 0.5112 H 1 UNL1111111111 0.1426 24 H 2.5926 -2.1907 -0.6660 H 1 UNL1111111111 0.1441 25 H 3.5401 -2.2754 0.8444 H 1 UNL1111111111 0.1181 26 H 4.3655 -2.2104 -0.7403 H 1 UNL1111111111 0.1434 27 H 5.6335 -0.2698 -0.0293 H 1 UNL1111111111 0.1441 28 H 4.8189 -0.0879 1.5505 H 1 UNL1111111111 0.1176 29 H 4.7958 1.2441 0.3558 H 1 UNL1111111111 0.1440 30 H -4.8971 1.1387 -0.1373 H 1 UNL1111111111 0.1438 31 H -4.9665 0.1147 1.3285 H 1 UNL1111111111 0.1173 32 H -5.6111 -0.4812 -0.2278 H 1 UNL1111111111 0.1444 33 H -2.4150 -2.2597 -0.1188 H 1 UNL1111111111 0.1454 34 H -4.1681 -2.4393 -0.3366 H 1 UNL1111111111 0.1432 35 H -3.5040 -2.0571 1.2800 H 1 UNL1111111111 0.1182 @BOND 1 1 4 1 2 1 5 1 3 1 8 1 4 2 6 1 5 2 9 1 6 2 10 1 7 3 7 1 8 3 11 1 9 3 12 1 10 4 6 1 11 4 13 1 12 4 14 1 13 5 7 1 14 5 15 1 15 5 16 1 16 6 17 1 17 6 18 1 18 7 19 1 19 7 20 1 20 8 21 1 21 8 22 1 22 8 23 1 23 9 24 1 24 9 25 1 25 9 26 1 26 10 27 1 27 10 28 1 28 10 29 1 29 11 30 1 30 11 31 1 31 11 32 1 32 12 33 1 33 12 34 1 34 12 35 1