@MOLECULE solstitialin a 40 42 0 0 0 SMALL GASTEIGER @ATOM 1 O 0.8283 -1.5363 0.0940 O.3 1 UNL111111111 -0.3947 2 O 3.0756 0.3794 -1.4892 O.3 1 UNL111111111 -0.5186 3 O -4.2211 -0.8418 0.8472 O.3 1 UNL111111111 -0.5487 4 O 2.9491 -2.2087 -0.0048 O.2 1 UNL111111111 -0.4530 5 O 4.6029 0.0873 0.7657 O.3 1 UNL111111111 -0.5398 6 C -1.1567 -0.4989 -0.7199 C.3 1 UNL111111111 -0.1590 7 C 0.0904 -0.2973 0.1379 C.3 1 UNL111111111 0.1044 8 C 1.0373 0.8104 -0.3901 C.3 1 UNL111111111 -0.1940 9 C -1.9153 0.8469 -0.9398 C.3 1 UNL111111111 -0.1108 10 C 2.4399 0.1951 -0.2551 C.3 1 UNL111111111 0.1266 11 C -3.4039 0.4535 -1.0624 C.3 1 UNL111111111 -0.3450 12 C 0.8260 2.1309 0.3444 C.3 1 UNL111111111 -0.2599 13 C -2.1621 -1.4235 -0.0932 C.2 1 UNL111111111 -0.0241 14 C -3.5555 -0.9313 -0.4006 C.3 1 UNL111111111 0.1439 15 C -1.6490 1.8069 0.1907 C.2 1 UNL111111111 0.0129 16 C -0.5191 2.7693 -0.0471 C.3 1 UNL111111111 -0.2921 17 C 2.1593 -1.3093 -0.0626 C.2 1 UNL111111111 0.5403 18 C 3.3367 0.6922 0.8890 C.3 1 UNL111111111 -0.0513 19 C -1.9102 -2.5109 0.6280 C.2 1 UNL111111111 -0.2949 20 C -2.3156 1.7952 1.3459 C.2 1 UNL111111111 -0.3509 21 H -0.8520 -0.9222 -1.7113 H 1 UNL111111111 0.1695 22 H -0.1698 -0.1611 1.2118 H 1 UNL111111111 0.1591 23 H 0.8556 0.9783 -1.4861 H 1 UNL111111111 0.1869 24 H -1.5802 1.3044 -1.8997 H 1 UNL111111111 0.1418 25 H 1.6451 2.8361 0.0963 H 1 UNL111111111 0.1499 26 H 0.8618 1.9865 1.4414 H 1 UNL111111111 0.1458 27 H -4.0579 1.2003 -0.5825 H 1 UNL111111111 0.1594 28 H -3.7074 0.4170 -2.1214 H 1 UNL111111111 0.1447 29 H -4.1214 -1.6451 -1.0373 H 1 UNL111111111 0.1225 30 H -0.4908 3.0985 -1.1045 H 1 UNL111111111 0.1475 31 H -0.6689 3.7000 0.5368 H 1 UNL111111111 0.1492 32 H 2.9099 0.4887 1.8861 H 1 UNL111111111 0.1358 33 H 3.5642 1.7721 0.7925 H 1 UNL111111111 0.1617 34 H -2.6902 -3.1228 1.0589 H 1 UNL111111111 0.1573 35 H -0.9146 -2.8694 0.8533 H 1 UNL111111111 0.1676 36 H 4.0493 0.2091 -1.3984 H 1 UNL111111111 0.3452 37 H -3.1009 1.0850 1.5753 H 1 UNL111111111 0.1740 38 H -2.1221 2.4740 2.1591 H 1 UNL111111111 0.1439 39 H -5.1289 -0.5036 0.7293 H 1 UNL111111111 0.3086 40 H 4.5259 -0.8980 0.8063 H 1 UNL111111111 0.3384 @BOND 1 1 7 1 2 1 17 1 3 2 10 1 4 2 36 1 5 3 14 1 6 3 39 1 7 4 17 2 8 5 18 1 9 5 40 1 10 6 7 1 11 6 9 1 12 6 13 1 13 6 21 1 14 7 8 1 15 7 22 1 16 8 10 1 17 8 12 1 18 8 23 1 19 9 11 1 20 9 15 1 21 9 24 1 22 10 17 1 23 10 18 1 24 11 14 1 25 11 27 1 26 11 28 1 27 12 16 1 28 12 25 1 29 12 26 1 30 13 14 1 31 13 19 2 32 14 29 1 33 15 16 1 34 15 20 2 35 16 30 1 36 16 31 1 37 18 32 1 38 18 33 1 39 19 34 1 40 19 35 1 41 20 37 1 42 20 38 1