0 mol 8 unq 0 iso 0 dist 9.68072 7.70793 11.4765 7.55301 9.86938 8.94096 numMergedOcc 0
1 mol 11 unq 0 iso 0 dist 5.70364 7.87306 8.82989 9.18782 9.81247 13.3945 numMergedOcc 0
2 mol 44 unq 0 iso 0 dist 4.97954 5.06773 8.17152 7.91356 7.23261 9.17518 numMergedOcc 0
3 mol 44 unq 1 iso 0 dist 4.97954 5.06773 8.17152 3.92405 6.20069 8.21833 numMergedOcc 0
4 mol 44 unq 2 iso 0 dist 9.20117 5.06773 10.0357 7.91356 8.96501 9.17518 numMergedOcc 0
5 mol 44 unq 3 iso 0 dist 8.72535 5.06773 7.37043 7.91356 9.4798 9.17518 numMergedOcc 0
6 mol 52 unq 0 iso 0 dist 9.89949 8.96804 5.45185 8.48826 8.6668 8.65019 numMergedOcc 0
7 mol 61 unq 0 iso 0 dist 9.68759 6.62881 5.81582 5.53349 8.36115 8.94097 numMergedOcc 0
8 mol 61 unq 1 iso 0 dist 9.68759 6.62881 5.81582 10.3751 9.31669 12.2446 numMergedOcc 0
9 mol 61 unq 2 iso 0 dist 9.68759 9.32999 4.83991 5.53349 8.36115 9.66368 numMergedOcc 0
10 mol 61 unq 3 iso 0 dist 9.68759 9.32999 4.83991 10.3751 9.31669 11.9399 numMergedOcc 0
11 mol 74 unq 0 iso 0 dist 7.15667 8.46846 5.62882 7.09879 9.53176 8.2657 numMergedOcc 0
12 mol 130 unq 0 iso 0 dist 5.17641 9.07483 9.38503 6.91022 6.01132 7.62145 numMergedOcc 0
13 mol 130 unq 1 iso 0 dist 7.54666 9.24876 5.49949 6.47346 6.01132 10.8926 numMergedOcc 0
14 mol 163 unq 0 iso 0 dist 9.36038 7.64106 3.64474 10.9684 8.70104 8.21476 numMergedOcc 0
15 mol 214 unq 0 iso 0 dist 6.22499 8.45863 6.83037 5.23668 9.39099 7.2498 numMergedOcc 0
16 mol 232 unq 0 iso 0 dist 9.90909 9.3946 4.92492 10.238 7.83802 11.9056 numMergedOcc 0
17 mol 248 unq 0 iso 0 dist 7.11548 5.75155 5.82647 5.28545 8.97536 8.42446 numMergedOcc 0
