0 mol 1 unq 0 iso 0 dist 9.33719 9.34725 10.4572 7.42008 8.61411 13.4579 numMergedOcc 0
1 mol 1 unq 1 iso 0 dist 9.33719 9.30501 11.3264 7.42008 8.61411 14.989 numMergedOcc 0
2 mol 6 unq 0 iso 0 dist 4.75521 9.29636 5.15774 6.11052 9.78307 14.7059 numMergedOcc 0
3 mol 14 unq 0 iso 0 dist 6.69294 9.24546 10.7182 13.7871 9.42142 19.8949 numMergedOcc 0
4 mol 14 unq 1 iso 0 dist 6.69294 7.79091 12.3636 13.7871 9.42142 21.0935 numMergedOcc 0
5 mol 14 unq 2 iso 0 dist 5.35021 9.54103 12.1744 11.3079 9.42142 20.4327 numMergedOcc 0
6 mol 73 unq 0 iso 0 dist 8.91858 8.50028 4.63063 16.776 9.10386 12.5369 numMergedOcc 0
7 mol 83 unq 0 iso 0 dist 6.21251 7.6104 12.8269 6.40918 6.98121 11.942 numMergedOcc 0
8 mol 89 unq 0 iso 0 dist 5.37527 9.48297 4.94782 5.97457 7.24906 11.0003 numMergedOcc 0
9 mol 99 unq 0 iso 0 dist 6.24473 5.57391 4.74328 6.27172 5.33644 5.61946 numMergedOcc 0
10 mol 131 unq 0 iso 0 dist 6.30762 8.98949 10.1774 9.30741 8.89412 16.1271 numMergedOcc 0
11 mol 133 unq 0 iso 0 dist 4.84604 6.29879 5.35551 9.45934 6.85651 6.9268 numMergedOcc 0
12 mol 133 unq 1 iso 0 dist 4.84604 6.29879 5.35551 5.10912 7.03858 8.19166 numMergedOcc 0
13 mol 133 unq 2 iso 0 dist 6.90904 6.53862 5.32245 6.53566 9.63488 12.2067 numMergedOcc 0
14 mol 133 unq 3 iso 0 dist 6.90904 6.53862 5.32245 4.77272 9.31907 5.84909 numMergedOcc 0
15 mol 134 unq 0 iso 0 dist 9.91507 9.67331 10.6104 11.6041 9.49104 15.9043 numMergedOcc 0
16 mol 154 unq 0 iso 0 dist 8.4581 8.10747 8.74561 13.5449 7.31277 12.9329 numMergedOcc 0
17 mol 205 unq 0 iso 0 dist 9.10711 8.96503 14.538 13.3146 8.56656 20.9844 numMergedOcc 0
18 mol 237 unq 0 iso 0 dist 8.81333 6.73849 6.51143 5.61195 8.37331 10.1948 numMergedOcc 0
19 mol 237 unq 1 iso 0 dist 8.81333 9.43875 16.3422 5.61195 8.37331 14.123 numMergedOcc 0
20 mol 279 unq 0 iso 0 dist 8.85653 8.12646 11.304 4.0145 9.71653 9.8701 numMergedOcc 0
