0 mol 7 unq 0 iso 0 dist 7.12105 6.04832 10.1959 5.82034 11.024 6.14469 numMergedOcc 0
1 mol 9 unq 0 iso 0 dist 7.51584 6.17406 8.88528 10.8146 8.076 7.35972 numMergedOcc 0
2 mol 9 unq 1 iso 0 dist 7.88249 9.68136 5.60208 12.2786 9.17615 7.35972 numMergedOcc 0
3 mol 9 unq 2 iso 0 dist 7.88249 9.68136 5.60208 16.2955 10.7794 9.93542 numMergedOcc 0
4 mol 48 unq 0 iso 0 dist 6.76398 6.71313 4.16161 13.3903 7.59316 8.29857 numMergedOcc 0
5 mol 48 unq 1 iso 0 dist 6.55145 6.54699 4.20245 13.2873 7.51285 8.19993 numMergedOcc 0
6 mol 85 unq 0 iso 0 dist 7.44723 9.35279 13.0828 18.1901 22.0093 9.66222 numMergedOcc 0
7 mol 85 unq 1 iso 0 dist 7.2072 9.35279 9.16969 18.1901 16.7543 9.66222 numMergedOcc 0
8 mol 98 unq 0 iso 0 dist 8.12456 6.90706 8.53212 10.1557 6.62972 7.14031 numMergedOcc 0
9 mol 133 unq 0 iso 0 dist 7.03758 7.84048 5.61022 4.29098 7.82544 6.84835 numMergedOcc 0
10 mol 133 unq 1 iso 0 dist 9.31778 7.84048 5.71483 4.29098 6.18808 6.84835 numMergedOcc 0
11 mol 133 unq 2 iso 0 dist 6.85886 6.49688 9.34112 14.6184 13.4305 8.95662 numMergedOcc 0
12 mol 171 unq 0 iso 0 dist 6.03843 7.03303 11.6944 7.23254 13.2038 5.25109 numMergedOcc 0
13 mol 171 unq 1 iso 0 dist 6.03843 7.03303 11.6944 8.97143 14.8717 8.21618 numMergedOcc 0
14 mol 181 unq 0 iso 0 dist 9.2826 6.2176 6.12563 8.51662 10.8083 7.22883 numMergedOcc 0
15 mol 235 unq 0 iso 0 dist 8.44085 5.3481 7.85398 11.5344 11.4177 6.94789 numMergedOcc 0
16 mol 237 unq 0 iso 0 dist 6.68833 8.20201 5.90415 10.9723 5.06628 8.10254 numMergedOcc 0
17 mol 237 unq 1 iso 0 dist 6.6655 8.08467 11.2776 11.2771 16.3123 8.10254 numMergedOcc 0
