0 mol 43 unq 0 iso 0 dist 8.06275 9.83489 8.03754 8.60781 9.83618 10.1053 numMergedOcc 0
1 mol 43 unq 1 iso 0 dist 8.90024 14.6778 8.03754 12.664 9.83618 10.1053 numMergedOcc 0
2 mol 61 unq 0 iso 0 dist 5.50504 8.01646 8.44473 5.31827 8.76003 10.8911 numMergedOcc 0
3 mol 109 unq 0 iso 0 dist 9.26438 16.2476 9.41191 10.7144 5.87358 7.32599 numMergedOcc 0
4 mol 109 unq 1 iso 0 dist 6.43255 9.88245 9.41191 9.77909 5.87358 7.32599 numMergedOcc 0
5 mol 109 unq 2 iso 0 dist 7.4389 4.83143 9.41191 8.77144 5.87358 7.32599 numMergedOcc 0
6 mol 126 unq 0 iso 0 dist 7.02525 10.7956 7.44723 7.79653 9.5574 7.4357 numMergedOcc 0
7 mol 134 unq 0 iso 0 dist 8.84656 15.0514 6.48328 13.386 5.42582 5.0903 numMergedOcc 0
8 mol 134 unq 1 iso 0 dist 4.9155 12.4563 8.86784 13.386 8.6355 10.0815 numMergedOcc 0
9 mol 134 unq 2 iso 0 dist 8.49987 10.0977 8.86784 15.6111 8.6355 10.0815 numMergedOcc 0
10 mol 134 unq 3 iso 0 dist 9.42271 10.9017 8.86784 11.8215 8.6355 10.0815 numMergedOcc 0
11 mol 152 unq 0 iso 0 dist 8.34839 8.6893 8.41774 4.99991 9.13561 10.8622 numMergedOcc 0
12 mol 176 unq 0 iso 0 dist 8.78509 11.4726 8.02366 12.1262 8.61331 16.4277 numMergedOcc 0
13 mol 178 unq 0 iso 0 dist 8.04723 8.33307 9.63185 11.7065 8.96511 6.70227 numMergedOcc 0
14 mol 187 unq 0 iso 0 dist 9.38169 9.61673 6.82787 5.11961 9.27478 10.7843 numMergedOcc 0
15 mol 220 unq 0 iso 0 dist 8.14644 5.41585 5.39218 8.02272 6.84247 9.46015 numMergedOcc 0
16 mol 220 unq 1 iso 0 dist 8.14644 5.41585 5.39218 9.32762 6.99002 4.51612 numMergedOcc 0
17 mol 277 unq 0 iso 0 dist 7.23956 10.2688 4.81916 12.9898 9.41725 6.20663 numMergedOcc 0
