0 mol 19 unq 0 iso 0 dist 8.18518 9.47909 10.2774 8.15772 10.5727 7.14945 numMergedOcc 0
1 mol 19 unq 1 iso 0 dist 8.18518 9.47909 10.2774 6.57145 4.54938 6.50337 numMergedOcc 0
2 mol 21 unq 0 iso 0 dist 8.85347 5.0018 5.68808 9.3814 11.3184 7.39438 numMergedOcc 0
3 mol 43 unq 0 iso 0 dist 9.05728 5.0553 10.871 11.8429 18.7988 9.07906 numMergedOcc 0
4 mol 43 unq 1 iso 0 dist 9.05728 5.0553 10.871 5.8542 12.4545 8.75567 numMergedOcc 0
5 mol 68 unq 0 iso 0 dist 9.7754 9.00217 10.135 14.94 18.6096 9.18809 numMergedOcc 0
6 mol 91 unq 0 iso 0 dist 8.30169 9.86879 6.76794 14.6669 15.8388 9.61935 numMergedOcc 0
7 mol 91 unq 1 iso 0 dist 8.91983 7.3937 6.76794 10.1552 15.8388 9.61935 numMergedOcc 0
8 mol 127 unq 0 iso 0 dist 6.65963 7.34368 6.3084 10.345 8.14887 8.82676 numMergedOcc 0
9 mol 127 unq 1 iso 0 dist 6.65963 7.34368 6.3084 12.9049 11.3474 8.17522 numMergedOcc 0
10 mol 127 unq 2 iso 0 dist 6.65963 7.34368 6.3084 12.7518 13.7695 8.14341 numMergedOcc 0
11 mol 127 unq 3 iso 0 dist 6.65963 7.34368 6.3084 4.87509 9.66262 6.54744 numMergedOcc 0
12 mol 127 unq 4 iso 0 dist 8.62711 7.34368 12.4721 10.345 9.30299 8.82676 numMergedOcc 0
13 mol 127 unq 5 iso 0 dist 8.62711 7.34368 12.4721 12.9049 14.9565 8.17522 numMergedOcc 0
14 mol 127 unq 6 iso 0 dist 8.62711 7.34368 12.4721 12.7518 18.1486 8.14341 numMergedOcc 0
15 mol 127 unq 7 iso 0 dist 8.62711 7.34368 12.4721 4.87509 13.3014 6.54744 numMergedOcc 0
16 mol 152 unq 0 iso 0 dist 8.44823 5.35463 10.5856 11.7248 18.415 8.86966 numMergedOcc 0
17 mol 152 unq 1 iso 0 dist 8.44823 5.35463 10.5856 6.4987 13.949 5.7527 numMergedOcc 0
18 mol 162 unq 0 iso 0 dist 9.89142 7.80955 5.05715 8.36842 11.4903 9.48488 numMergedOcc 0
19 mol 162 unq 1 iso 0 dist 8.06091 7.80955 5.65753 8.36842 11.3173 9.48488 numMergedOcc 0
20 mol 162 unq 2 iso 0 dist 8.15223 6.66396 5.65753 7.13269 11.3173 9.48488 numMergedOcc 0
21 mol 167 unq 0 iso 0 dist 7.83781 7.78684 6.38496 8.89995 12.4733 6.85239 numMergedOcc 0
22 mol 167 unq 1 iso 0 dist 7.83781 7.78684 6.38496 6.43506 9.87651 5.72735 numMergedOcc 0
23 mol 186 unq 0 iso 0 dist 8.32829 5.88987 12.5192 5.47219 12.3748 9.37545 numMergedOcc 0
24 mol 186 unq 1 iso 0 dist 8.32829 5.88987 12.5192 6.51869 13.8795 6.02579 numMergedOcc 0
25 mol 206 unq 0 iso 0 dist 7.0119 5.99766 6.13816 8.21044 13.4144 9.62822 numMergedOcc 0
26 mol 206 unq 1 iso 0 dist 7.0119 5.99766 6.13816 8.05113 12.5958 7.03546 numMergedOcc 0
27 mol 224 unq 0 iso 0 dist 7.04127 9.55911 4.32714 4.55824 6.61986 7.80754 numMergedOcc 0
28 mol 281 unq 0 iso 0 dist 9.65665 5.46236 9.16177 5.81338 14.518 6.49441 numMergedOcc 0
