@MOLECULE 10-hydroxy-2,4,6,8-undecatetraynamide 21 20 0 0 0 SMALL GASTEIGER @ATOM 1 O -6.3852 -1.1443 -0.4397 O.3 1 UNL1111111111 -0.5271 2 O 6.5970 0.9219 -0.4329 O.2 1 UNL1111111111 -0.4777 3 N 6.5156 -1.0807 0.5996 N.am 1 UNL1111111111 -0.6793 4 C -5.8919 0.1663 -0.2433 C.3 1 UNL1111111111 0.1958 5 C -6.4734 0.7688 1.0379 C.3 1 UNL1111111111 -0.4901 6 C -4.4474 0.1615 -0.2013 C.1 1 UNL1111111111 -0.0548 7 C -3.2318 0.1417 -0.1692 C.1 1 UNL1111111111 -0.0754 8 C -1.8781 0.1227 -0.1354 C.1 1 UNL1111111111 0.0427 9 C 5.9153 0.0240 0.0194 C.2 1 UNL1111111111 0.6249 10 C 4.4839 0.0076 0.0058 C.1 1 UNL1111111111 -0.1597 11 C -0.6576 0.1017 -0.1070 C.1 1 UNL1111111111 -0.0506 12 C 3.2685 0.0335 -0.0239 C.1 1 UNL1111111111 0.0561 13 C 0.6942 0.0786 -0.0769 C.1 1 UNL1111111111 0.0418 14 C 1.9146 0.0543 -0.0515 C.1 1 UNL1111111111 -0.0433 15 H -6.2787 0.6915 -1.1602 H 1 UNL1111111111 0.1699 16 H -6.2186 1.8306 1.1360 H 1 UNL1111111111 0.1629 17 H -6.1089 0.2567 1.9357 H 1 UNL1111111111 0.1574 18 H -7.5693 0.6865 1.0362 H 1 UNL1111111111 0.1685 19 H -6.1212 -1.7366 0.2949 H 1 UNL1111111111 0.3166 20 H 7.5129 -1.1363 0.6448 H 1 UNL1111111111 0.3145 21 H 5.9971 -1.8390 0.9812 H 1 UNL1111111111 0.3068 @BOND 1 1 4 1 2 1 19 1 3 2 9 2 4 3 9 am 5 3 20 1 6 3 21 1 7 4 5 1 8 4 6 1 9 4 15 1 10 5 16 1 11 5 17 1 12 5 18 1 13 6 7 3 14 7 8 1 15 8 11 3 16 9 10 1 17 10 12 3 18 11 13 1 19 12 14 1 20 13 14 3