0 mol 63 unq 0 iso 0 dist 9.54314 4.44905 6.89855 6.25029 7.85738 6.89847 12.9448 10.749 9.35912 15.7354 numMergedOcc 0
1 mol 73 unq 0 iso 0 dist 8.4515 13.3961 7.02693 9.15529 8.58248 15.1997 15.3124 8.69689 5.39171 14.6774 numMergedOcc 0
2 mol 73 unq 1 iso 0 dist 8.4515 13.3961 7.02693 9.15529 8.58248 15.1997 13.5192 8.0072 9.27355 10.4858 numMergedOcc 0
3 mol 73 unq 2 iso 0 dist 8.4515 13.3961 7.02693 9.15529 8.58248 15.1997 13.635 9.61302 8.60363 13.3367 numMergedOcc 0
4 mol 120 unq 0 iso 0 dist 8.83822 4.15475 5.24948 14.5868 7.50959 10.7404 12.1456 6.77231 9.66753 12.8241 numMergedOcc 0
5 mol 239 unq 0 iso 0 dist 8.37701 5.29911 7.24545 10.8809 9.2554 13.6162 8.58481 6.94281 6.00654 11.8339 numMergedOcc 0
6 mol 258 unq 0 iso 0 dist 6.61322 9.26732 5.94328 6.72414 7.91978 5.64447 10.3095 8.9947 8.97411 11.4777 numMergedOcc 0
7 mol 280 unq 0 iso 0 dist 9.22665 9.13465 7.00616 14.2183 9.19653 6.56107 7.10723 3.76721 7.02503 9.18164 numMergedOcc 0
8 mol 280 unq 1 iso 0 dist 9.22665 14.2183 9.19653 9.13465 7.00616 6.56107 7.10723 3.76721 9.18164 7.02503 numMergedOcc 0
9 mol 280 unq 2 iso 0 dist 9.84708 7.59724 7.00616 7.88431 9.19653 6.56107 6.8664 3.76721 7.02503 9.18164 numMergedOcc 0
10 mol 280 unq 3 iso 0 dist 9.84708 7.88431 9.19653 7.59724 7.00616 6.56107 6.8664 3.76721 9.18164 7.02503 numMergedOcc 0
11 mol 285 unq 0 iso 0 dist 5.28731 9.97666 9.66678 6.37482 7.08681 14.9873 17.2934 16.8309 8.63954 22.917 numMergedOcc 0
12 mol 285 unq 1 iso 0 dist 5.28731 9.97666 9.66678 6.37482 7.08681 14.9873 12.3495 10.6606 4.74716 17.2349 numMergedOcc 0
13 mol 287 unq 0 iso 0 dist 6.16127 5.66584 9.31611 5.27724 6.25845 10.6227 12.4464 14.6969 8.0935 17.5825 numMergedOcc 0
14 mol 288 unq 0 iso 0 dist 6.16127 5.66584 9.31611 5.27724 6.25845 10.6227 12.4464 14.6969 8.0935 17.5825 numMergedOcc 0
15 mol 289 unq 0 iso 0 dist 6.16127 5.66584 9.31611 5.27724 6.25845 10.6227 12.4464 14.6969 8.0935 17.5825 numMergedOcc 0
