0 mol 7 unq 0 iso 0 dist 9.20552 14.3372 6.8464 10.4548 5.99459 4.65291 numMergedOcc 0
1 mol 14 unq 0 iso 0 dist 8.64855 9.79416 5.36937 11.3463 8.84686 3.80208 numMergedOcc 0
2 mol 54 unq 0 iso 0 dist 6.72872 5.56571 9.20429 7.72003 7.16132 12.9186 numMergedOcc 0
3 mol 68 unq 0 iso 0 dist 5.9651 8.88456 9.40333 4.60844 9.8703 12.6908 numMergedOcc 0
4 mol 69 unq 0 iso 0 dist 8.27307 7.18248 7.25721 5.29207 5.99857 3.77519 numMergedOcc 0
5 mol 89 unq 0 iso 0 dist 8.56124 11.2044 9.6629 4.56271 6.53308 8.04878 numMergedOcc 0
6 mol 89 unq 1 iso 0 dist 8.56124 11.2044 9.6629 4.20641 7.47974 11.9796 numMergedOcc 0
7 mol 109 unq 0 iso 0 dist 9.26438 16.2476 9.41191 7.53887 7.07971 9.45977 numMergedOcc 0
8 mol 109 unq 1 iso 0 dist 6.43255 9.88245 9.41191 7.83378 7.07971 9.45977 numMergedOcc 0
9 mol 109 unq 2 iso 0 dist 7.4389 4.83143 9.41191 10.405 7.07971 9.45977 numMergedOcc 0
10 mol 122 unq 0 iso 0 dist 8.47907 14.9119 8.75778 12.3287 6.00603 4.06619 numMergedOcc 0
11 mol 134 unq 0 iso 0 dist 8.84656 15.0514 6.48328 14.2595 9.33924 9.80637 numMergedOcc 0
12 mol 134 unq 1 iso 0 dist 8.84656 15.0514 6.48328 15.9796 7.93372 7.07082 numMergedOcc 0
13 mol 154 unq 0 iso 0 dist 7.34207 6.84292 6.36439 13.1744 8.33439 7.59527 numMergedOcc 0
14 mol 162 unq 0 iso 0 dist 5.21803 5.58809 7.69229 4.6728 7.37333 6.69138 numMergedOcc 0
15 mol 162 unq 1 iso 0 dist 5.21803 5.58809 7.69229 7.06734 7.45998 6.82744 numMergedOcc 0
16 mol 178 unq 0 iso 0 dist 8.04723 8.33307 9.63185 12.8554 9.11204 11.4463 numMergedOcc 0
17 mol 197 unq 0 iso 0 dist 6.18446 4.80458 8.67786 9.66766 9.10817 6.57766 numMergedOcc 0
18 mol 197 unq 1 iso 0 dist 6.18446 4.80458 8.67786 7.69814 9.73548 12.3362 numMergedOcc 0
19 mol 205 unq 0 iso 0 dist 8.57514 8.8747 6.94789 12.7286 6.49765 6.16492 numMergedOcc 0
20 mol 205 unq 1 iso 0 dist 8.57514 12.2424 6.23932 12.7286 6.49765 9.99561 numMergedOcc 0
21 mol 205 unq 2 iso 0 dist 6.11505 9.55713 6.94789 12.0822 6.49765 6.16492 numMergedOcc 0
22 mol 205 unq 3 iso 0 dist 6.11505 9.51216 6.23932 12.0822 6.49765 9.99561 numMergedOcc 0
23 mol 233 unq 0 iso 0 dist 6.48196 4.26152 7.41931 5.17683 8.51625 8.98854 numMergedOcc 0
24 mol 267 unq 0 iso 0 dist 7.94474 4.50603 9.44648 10.6273 8.8293 14.5438 numMergedOcc 0
25 mol 277 unq 0 iso 0 dist 7.23956 10.2688 4.81916 8.60807 9.35539 9.31926 numMergedOcc 0
26 mol 277 unq 1 iso 0 dist 7.23956 10.2688 4.81916 10.3171 8.9682 13.1828 numMergedOcc 0
27 mol 277 unq 2 iso 0 dist 7.23956 10.2688 4.81916 10.6814 6.92711 10.6994 numMergedOcc 0
