@MOLECULE 1,4-anhydroerythritol 15 15 0 0 0 SMALL GASTEIGER @ATOM 1 O -1.5584 0.5243 -0.4353 O.3 1 UNL1111111111 -0.3926 2 O 0.6635 -1.5948 -0.4913 O.3 1 UNL1111111111 -0.5414 3 O 1.8542 0.7187 -0.1198 O.3 1 UNL1111111111 -0.5404 4 C 0.0806 -0.8651 0.5611 C.3 1 UNL1111111111 0.0596 5 C 0.6344 0.5914 0.5553 C.3 1 UNL1111111111 0.0667 6 C -1.4219 -0.6634 0.3359 C.3 1 UNL1111111111 -0.1085 7 C -0.4606 1.3965 -0.1696 C.3 1 UNL1111111111 -0.0980 8 H 0.3526 -1.4475 1.4600 H 1 UNL1111111111 0.1572 9 H 0.8461 0.9716 1.5754 H 1 UNL1111111111 0.1458 10 H -1.8905 -1.4519 -0.2759 H 1 UNL1111111111 0.1559 11 H -1.9854 -0.5379 1.2746 H 1 UNL1111111111 0.1375 12 H -0.8518 2.2332 0.4283 H 1 UNL1111111111 0.1359 13 H -0.1329 1.7633 -1.1572 H 1 UNL1111111111 0.1565 14 H 0.2843 -1.3168 -1.3573 H 1 UNL1111111111 0.3290 15 H 2.0631 -0.1044 -0.6226 H 1 UNL1111111111 0.3369 @BOND 1 1 6 1 2 1 7 1 3 2 4 1 4 2 14 1 5 3 5 1 6 3 15 1 7 4 5 1 8 4 6 1 9 4 8 1 10 5 7 1 11 5 9 1 12 6 10 1 13 6 11 1 14 7 12 1 15 7 13 1