0 mol 16 unq 0 iso 0 dist 9.76968 8.55371 5.47769 8.8641 6.92781 7.03948 5.33179 11.0298 9.87867 6.42835 numMergedOcc 0
1 mol 16 unq 1 iso 0 dist 9.76968 8.55371 5.47769 8.8641 6.92781 7.03948 5.36195 8.43054 4.68733 6.57331 numMergedOcc 0
2 mol 73 unq 0 iso 0 dist 8.2377 12.6436 5.64598 14.7651 7.4697 8.70133 18.6634 10.9476 6.15714 9.73086 numMergedOcc 0
3 mol 73 unq 1 iso 0 dist 8.2377 12.6436 5.64598 12.864 5.7113 4.65521 18.5625 11.6739 6.10063 8.68662 numMergedOcc 0
4 mol 73 unq 2 iso 0 dist 8.2377 12.6436 5.64598 12.864 5.7113 4.65521 18.6634 10.9476 6.15714 7.4369 numMergedOcc 0
5 mol 73 unq 3 iso 0 dist 6.18305 4.31731 4.65521 11.0671 5.4148 8.70133 5.65986 7.4369 6.15714 9.73086 numMergedOcc 0
6 mol 76 unq 0 iso 0 dist 8.58841 13.8628 8.19682 17.86 10.2879 6.21982 16.3337 9.85905 4.00608 6.72869 numMergedOcc 0
7 mol 115 unq 0 iso 0 dist 5.02717 9.81097 8.66155 12.5189 7.69052 9.66954 12.6105 9.42082 6.49835 6.39384 numMergedOcc 0
8 mol 130 unq 0 iso 0 dist 5.49877 6.53156 6.89257 9.72083 7.50049 7.66168 8.17131 10.4564 4.02212 9.98797 numMergedOcc 0
9 mol 130 unq 1 iso 0 dist 5.49877 4.72188 8.74308 9.72083 7.50049 9.12581 8.17131 10.4564 5.46642 9.98797 numMergedOcc 0
10 mol 134 unq 0 iso 0 dist 9.92932 6.27009 8.79571 9.60411 5.49782 5.42582 11.6349 13.9752 6.0991 9.33924 numMergedOcc 0
11 mol 134 unq 1 iso 0 dist 9.92932 6.27009 8.79571 9.60411 5.49782 5.42582 3.76211 7.21868 5.67107 7.93372 numMergedOcc 0
12 mol 134 unq 2 iso 0 dist 9.60411 6.27009 5.42582 9.92932 5.49782 8.79571 3.76211 7.93372 5.67107 7.21868 numMergedOcc 0
13 mol 134 unq 3 iso 0 dist 9.55556 10.2625 8.79571 12.1043 5.49782 5.42582 15.7509 13.9752 6.0991 9.33924 numMergedOcc 0
14 mol 134 unq 4 iso 0 dist 9.55556 10.2625 8.79571 12.1043 5.49782 5.42582 4.63732 7.21868 5.67107 7.93372 numMergedOcc 0
15 mol 155 unq 0 iso 0 dist 6.7973 5.10076 7.16254 10.6879 5.71071 9.14392 13.6883 12.9034 12.0485 8.97626 numMergedOcc 0
16 mol 155 unq 1 iso 0 dist 6.7973 9.64056 9.86313 10.6879 5.71071 7.51198 13.6883 12.9034 4.48516 8.97626 numMergedOcc 0
17 mol 235 unq 0 iso 0 dist 9.11256 14.9183 9.58736 20.3048 16.4493 6.98084 17.9334 11.0129 4.47008 8.19317 numMergedOcc 0
18 mol 235 unq 1 iso 0 dist 9.11256 14.9183 9.58736 20.3048 16.4493 6.98084 20.9019 15.1974 7.34601 6.29377 numMergedOcc 0
19 mol 235 unq 2 iso 0 dist 9.11256 14.9183 9.58736 22.1086 15.4 7.32211 17.9334 11.0129 4.47008 5.1823 numMergedOcc 0
20 mol 235 unq 3 iso 0 dist 9.11256 14.9183 9.58736 22.1086 15.4 7.32211 20.9019 15.1974 7.34601 5.70635 numMergedOcc 0
21 mol 235 unq 4 iso 0 dist 7.08539 4.28284 9.58736 10.3464 16.4493 6.98084 4.46929 11.0129 4.47008 8.19317 numMergedOcc 0
22 mol 235 unq 5 iso 0 dist 7.08539 4.28284 9.58736 10.3464 16.4493 6.98084 8.12922 15.1974 7.34601 6.29377 numMergedOcc 0
23 mol 235 unq 6 iso 0 dist 7.08539 4.28284 9.58736 9.4144 15.4 7.32211 4.46929 11.0129 4.47008 5.1823 numMergedOcc 0
24 mol 235 unq 7 iso 0 dist 7.08539 4.28284 9.58736 9.4144 15.4 7.32211 8.12922 15.1974 7.34601 5.70635 numMergedOcc 0
25 mol 236 unq 0 iso 0 dist 8.90987 14.3961 7.17676 11.2664 7.28249 5.34718 5.14597 10.1317 13.0765 9.3206 numMergedOcc 0
26 mol 238 unq 0 iso 0 dist 9.13537 6.16476 5.38637 9.01016 5.42006 6.55759 16.4705 13.9551 15.4844 9.12776 numMergedOcc 0
27 mol 238 unq 1 iso 0 dist 9.66555 8.92175 7.49471 11.6545 5.34096 7.19008 3.68226 8.69015 6.12722 9.12776 numMergedOcc 0
28 mol 238 unq 2 iso 0 dist 8.67205 5.94371 7.49471 11.1363 5.34096 7.19008 5.17124 8.69015 6.12722 9.12776 numMergedOcc 0
29 mol 259 unq 0 iso 0 dist 9.12507 4.09442 8.37865 10.5892 12.5353 7.48005 9.6255 17.0253 9.98303 9.63573 numMergedOcc 0
30 mol 259 unq 1 iso 0 dist 9.12507 4.09442 8.37865 10.5892 12.5353 7.48005 16.4535 20.1127 14.0829 7.66153 numMergedOcc 0
