@MOLECULE 1,4,10,13-tetraoxa-7,16-diazacyclooctadecane 44 44 0 0 0 SMALL GASTEIGER @ATOM 1 O -2.0104 2.2592 -0.2938 O.3 1 UNL1111111111 -0.4143 2 O 1.0744 2.8139 0.2973 O.3 1 UNL1111111111 -0.4141 3 O -1.0738 -2.8153 -0.3166 O.3 1 UNL1111111111 -0.4147 4 O 2.0146 -2.2711 0.3144 O.3 1 UNL1111111111 -0.4142 5 N -2.9145 -0.5073 0.3247 N.3 1 UNL1111111111 -0.5385 6 N 2.9123 0.5053 -0.3176 N.3 1 UNL1111111111 -0.5391 7 C -3.6498 0.6064 -0.3175 C.3 1 UNL1111111111 -0.1283 8 C -3.1675 -1.7910 -0.3685 C.3 1 UNL1111111111 -0.1285 9 C 3.1727 1.8009 0.3498 C.3 1 UNL1111111111 -0.1280 10 C 3.6400 -0.6012 0.3449 C.3 1 UNL1111111111 -0.1284 11 C -3.2231 1.9178 0.3631 C.3 1 UNL1111111111 -0.0519 12 C 2.3344 2.8795 -0.3564 C.3 1 UNL1111111111 -0.0509 13 C -2.3378 -2.8818 0.3292 C.3 1 UNL1111111111 -0.0504 14 C 3.2289 -1.9186 -0.3337 C.3 1 UNL1111111111 -0.0516 15 C -1.2177 3.1905 0.4279 C.3 1 UNL1111111111 -0.0565 16 C 0.0169 3.3860 -0.4585 C.3 1 UNL1111111111 -0.0563 17 C -0.0207 -3.3908 0.4429 C.3 1 UNL1111111111 -0.0562 18 C 1.2206 -3.1830 -0.4312 C.3 1 UNL1111111111 -0.0566 19 H -4.7379 0.4392 -0.1710 H 1 UNL1111111111 0.1378 20 H -3.4658 0.6789 -1.4126 H 1 UNL1111111111 0.1312 21 H -2.9096 -1.7630 -1.4508 H 1 UNL1111111111 0.1323 22 H -4.2494 -2.0284 -0.2890 H 1 UNL1111111111 0.1371 23 H 4.2537 2.0366 0.2531 H 1 UNL1111111111 0.1372 24 H 2.9285 1.7917 1.4356 H 1 UNL1111111111 0.1321 25 H 3.4386 -0.6660 1.4371 H 1 UNL1111111111 0.1313 26 H 4.7302 -0.4323 0.2153 H 1 UNL1111111111 0.1375 27 H -3.9522 2.7268 0.1921 H 1 UNL1111111111 0.1142 28 H -3.0663 1.7790 1.4477 H 1 UNL1111111111 0.1365 29 H 2.7500 3.8894 -0.2044 H 1 UNL1111111111 0.1142 30 H 2.2391 2.6743 -1.4377 H 1 UNL1111111111 0.1374 31 H -2.2479 -2.6903 1.4135 H 1 UNL1111111111 0.1375 32 H -2.7569 -3.8879 0.1624 H 1 UNL1111111111 0.1142 33 H 3.0823 -1.7845 -1.4204 H 1 UNL1111111111 0.1367 34 H 3.9627 -2.7212 -0.1530 H 1 UNL1111111111 0.1144 35 H -1.9102 -0.3039 0.3357 H 1 UNL1111111111 0.2763 36 H 1.9069 0.3079 -0.3263 H 1 UNL1111111111 0.2763 37 H -0.9376 2.7636 1.4113 H 1 UNL1111111111 0.1444 38 H -1.7831 4.1245 0.5737 H 1 UNL1111111111 0.1165 39 H -0.0939 2.8458 -1.4196 H 1 UNL1111111111 0.1445 40 H 0.2315 4.4494 -0.6502 H 1 UNL1111111111 0.1167 41 H -0.2340 -4.4562 0.6238 H 1 UNL1111111111 0.1167 42 H 0.0811 -2.8586 1.4095 H 1 UNL1111111111 0.1445 43 H 1.7823 -4.1165 -0.5928 H 1 UNL1111111111 0.1165 44 H 0.9484 -2.7345 -1.4071 H 1 UNL1111111111 0.1445 @BOND 1 1 11 1 2 1 15 1 3 2 12 1 4 2 16 1 5 3 13 1 6 3 17 1 7 4 14 1 8 4 18 1 9 5 7 1 10 5 8 1 11 5 35 1 12 6 9 1 13 6 10 1 14 6 36 1 15 7 11 1 16 7 19 1 17 7 20 1 18 8 13 1 19 8 21 1 20 8 22 1 21 9 12 1 22 9 23 1 23 9 24 1 24 10 14 1 25 10 25 1 26 10 26 1 27 11 27 1 28 11 28 1 29 12 29 1 30 12 30 1 31 13 31 1 32 13 32 1 33 14 33 1 34 14 34 1 35 15 16 1 36 15 37 1 37 15 38 1 38 16 39 1 39 16 40 1 40 17 18 1 41 17 41 1 42 17 42 1 43 18 43 1 44 18 44 1