@MOLECULE [(2r,3r)-3-(1,3,5-heptatriyn-1-yl)-2-oxiranyl]methanol 20 20 0 0 0 SMALL GASTEIGER @ATOM 1 O 2.9013 -1.4906 -0.0988 O.3 1 UNL1111111111 -0.3100 2 O 4.7324 1.4552 0.1803 O.3 1 UNL1111111111 -0.5267 3 C 3.2010 -0.2075 -0.6505 C.3 1 UNL1111111111 -0.0489 4 C 2.3348 -0.3499 0.5691 C.3 1 UNL1111111111 0.0489 5 C 4.6450 0.2198 -0.4945 C.3 1 UNL1111111111 -0.0289 6 C 0.9268 -0.2165 0.4577 C.1 1 UNL1111111111 -0.0880 7 C -0.2823 -0.1238 0.3538 C.1 1 UNL1111111111 -0.0024 8 C -1.6271 -0.0301 0.2229 C.1 1 UNL1111111111 -0.0536 9 C -2.8399 0.0334 0.0985 C.1 1 UNL1111111111 0.0330 10 C -6.8150 0.2341 -0.2667 C.3 1 UNL1111111111 -0.4136 11 C -4.1855 0.1070 -0.0377 C.1 1 UNL1111111111 -0.1251 12 C -5.3967 0.1655 -0.1453 C.1 1 UNL1111111111 0.0338 13 H 2.7392 -0.0139 -1.6222 H 1 UNL1111111111 0.1602 14 H 2.7667 -0.1563 1.5672 H 1 UNL1111111111 0.1860 15 H 5.1665 0.2867 -1.4672 H 1 UNL1111111111 0.1269 16 H 5.2092 -0.4695 0.1690 H 1 UNL1111111111 0.1648 17 H 4.2598 2.1571 -0.3128 H 1 UNL1111111111 0.3121 18 H -7.1676 -0.1359 -1.2490 H 1 UNL1111111111 0.1771 19 H -7.3270 -0.3730 0.5056 H 1 UNL1111111111 0.1776 20 H -7.1925 1.2697 -0.1611 H 1 UNL1111111111 0.1768 @BOND 1 1 3 1 2 1 4 1 3 2 5 1 4 2 17 1 5 3 4 1 6 3 5 1 7 3 13 1 8 4 6 1 9 4 14 1 10 5 15 1 11 5 16 1 12 6 7 3 13 7 8 1 14 8 9 3 15 9 11 1 16 10 12 1 17 10 18 1 18 10 19 1 19 10 20 1 20 11 12 3