@MOLECULE esgram 28 29 0 0 0 SMALL USER_CHARGES @ATOM 1 N -3.5245 -0.0051 -0.0491 N.ar 1 UNL1111111 -0.3354 2 N 3.5510 -0.0004 0.1626 N.ar 1 UNL1111111 -0.3324 3 C -0.6789 -0.0013 0.0383 C.ar 1 UNL1111111 -0.0104 4 C 0.6861 0.0033 0.0680 C.ar 1 UNL1111111 -0.0521 5 C -1.4681 -1.2229 0.0225 C.ar 1 UNL1111111 -0.2526 6 C 1.4786 1.2233 0.0779 C.ar 1 UNL1111111 -0.2278 7 C -1.4703 1.2170 0.0203 C.ar 1 UNL1111111 -0.2477 8 C 1.4765 -1.2169 0.0761 C.ar 1 UNL1111111 -0.2276 9 C -2.8245 -1.2041 -0.0171 C.ar 1 UNL1111111 0.0306 10 C 2.8298 -1.1990 0.0675 C.ar 1 UNL1111111 0.0051 11 C -2.8260 1.1971 -0.0193 C.ar 1 UNL1111111 0.0257 12 C 2.8324 1.1999 0.0700 C.ar 1 UNL1111111 0.0059 13 C -4.9827 0.0089 -0.0911 C.3 1 UNL1111111 -0.2345 14 C 4.9319 -0.0013 -0.3325 C.3 1 UNL1111111 -0.2471 15 H -0.9417 -2.1725 0.0461 H 1 UNL1111111 0.1593 16 H 0.9527 2.1733 0.0888 H 1 UNL1111111 0.1546 17 H -0.9442 2.1670 0.0419 H 1 UNL1111111 0.1592 18 H 0.9473 -2.1657 0.0871 H 1 UNL1111111 0.1549 19 H -3.4260 -2.1142 -0.0278 H 1 UNL1111111 0.1481 20 H 3.4312 -2.1086 0.0536 H 1 UNL1111111 0.1473 21 H -3.4315 2.1046 -0.0322 H 1 UNL1111111 0.1494 22 H 3.4364 2.1075 0.0585 H 1 UNL1111111 0.1472 23 H -5.3903 -1.0045 -0.2458 H 1 UNL1111111 0.1507 24 H -5.3998 0.4005 0.8552 H 1 UNL1111111 0.1461 25 H -5.3447 0.6423 -0.9218 H 1 UNL1111111 0.1477 26 H 4.9850 0.0111 -1.4349 H 1 UNL1111111 0.1372 27 H 5.4721 0.8809 0.0533 H 1 UNL1111111 0.1493 28 H 5.4646 -0.8967 0.0326 H 1 UNL1111111 0.1494 @BOND 1 26 14 1 2 25 13 1 3 14 28 1 4 14 27 1 5 14 2 1 6 23 13 1 7 13 1 1 8 13 24 1 9 1 11 ar 10 1 9 ar 11 21 11 1 12 19 9 1 13 11 7 ar 14 9 5 ar 15 7 3 ar 16 7 17 1 17 5 3 ar 18 5 15 1 19 3 4 1 20 20 10 1 21 22 12 1 22 10 8 ar 23 10 2 ar 24 4 8 ar 25 4 6 ar 26 12 6 ar 27 12 2 ar 28 8 18 1 29 6 16 1