0 mol 16 unq 0 iso 0 dist 9.76968 8.55371 5.47769 8.8641 6.92781 7.03948 4.2139 6.31718 6.2983 5.05803 numMergedOcc 0
1 mol 16 unq 1 iso 0 dist 9.76968 8.55371 5.47769 13.862 5.32694 6.58035 12.1754 7.63133 5.94084 5.46498 numMergedOcc 0
2 mol 58 unq 0 iso 0 dist 4.88613 9.80755 8.89374 9.01612 5.35073 8.63333 5.40367 6.35756 6.47744 6.86465 numMergedOcc 0
3 mol 58 unq 1 iso 0 dist 4.88613 9.80755 8.89374 10.3132 8.62958 6.46761 11.7483 12.1902 5.24906 6.64012 numMergedOcc 0
4 mol 58 unq 2 iso 0 dist 4.88613 9.80755 8.89374 16.5848 14.176 9.73139 11.7483 12.1902 5.24906 9.4099 numMergedOcc 0
5 mol 58 unq 3 iso 0 dist 4.88613 9.80755 8.89374 16.5848 14.176 9.73139 21.9257 20.984 13.1021 9.55426 numMergedOcc 0
6 mol 73 unq 0 iso 0 dist 8.2377 12.6436 5.64598 14.7651 7.4697 8.70133 9.98709 8.9232 13.4082 9.38498 numMergedOcc 0
7 mol 73 unq 1 iso 0 dist 8.2377 12.6436 5.64598 14.7651 7.4697 8.70133 18.1626 11.4799 7.41074 9.96396 numMergedOcc 0
8 mol 73 unq 2 iso 0 dist 8.2377 12.6436 5.64598 14.7651 7.4697 8.70133 21.9286 16.0453 15.9882 9.75218 numMergedOcc 0
9 mol 73 unq 3 iso 0 dist 8.2377 12.6436 5.64598 12.864 5.7113 4.65521 18.1626 11.4799 7.41074 6.19304 numMergedOcc 0
10 mol 73 unq 4 iso 0 dist 6.18305 4.31731 4.65521 11.0671 5.4148 8.70133 15.7901 10.2049 13.4082 9.38498 numMergedOcc 0
11 mol 73 unq 5 iso 0 dist 6.18305 4.31731 4.65521 11.0671 5.4148 8.70133 4.69583 6.19304 7.41074 9.96396 numMergedOcc 0
12 mol 73 unq 6 iso 0 dist 6.18305 4.31731 4.65521 11.0671 5.4148 8.70133 15.8603 11.6369 15.9882 9.75218 numMergedOcc 0
13 mol 73 unq 7 iso 0 dist 6.18305 4.31731 4.65521 9.43662 5.7113 5.64598 13.3852 11.379 9.77992 5.93252 numMergedOcc 0
14 mol 115 unq 0 iso 0 dist 5.02717 9.81097 8.66155 12.5189 7.69052 9.66954 6.75472 5.83991 6.09023 9.33865 numMergedOcc 0
15 mol 115 unq 1 iso 0 dist 5.02717 9.81097 8.66155 12.5189 7.69052 9.66954 11.0268 7.88312 4.61908 6.11741 numMergedOcc 0
16 mol 119 unq 0 iso 0 dist 7.91337 6.02826 7.39889 11.7745 11.6667 9.63176 13.6062 16.7981 10.6679 8.73993 numMergedOcc 0
17 mol 119 unq 1 iso 0 dist 7.91337 6.02826 7.39889 13.3911 11.3169 7.44174 10.8613 14.5183 7.36192 9.87172 numMergedOcc 0
18 mol 131 unq 0 iso 0 dist 7.81337 6.25099 6.91348 10.4432 6.63273 8.6243 11.4498 6.85062 6.19596 7.12972 numMergedOcc 0
19 mol 134 unq 0 iso 0 dist 9.92932 6.27009 8.79571 9.60411 5.49782 5.42582 10.5108 8.94367 5.41704 6.37586 numMergedOcc 0
20 mol 134 unq 1 iso 0 dist 9.92932 6.27009 8.79571 9.60411 5.49782 5.42582 6.20443 9.86662 6.17103 9.71307 numMergedOcc 0
21 mol 134 unq 2 iso 0 dist 9.92932 6.27009 8.79571 14.0674 8.80819 8.6355 15.5033 11.9139 10.1448 6.54501 numMergedOcc 0
22 mol 134 unq 3 iso 0 dist 9.92932 6.27009 8.79571 14.0674 8.80819 8.6355 10.5108 8.94367 5.41704 6.49416 numMergedOcc 0
23 mol 134 unq 4 iso 0 dist 9.60411 6.27009 5.42582 9.92932 5.49782 8.79571 10.5108 6.37586 5.41704 8.94367 numMergedOcc 0
24 mol 134 unq 5 iso 0 dist 9.60411 6.27009 5.42582 9.92932 5.49782 8.79571 6.20443 9.71307 6.17103 9.86662 numMergedOcc 0
25 mol 134 unq 6 iso 0 dist 9.60411 6.27009 5.42582 14.0674 5.00817 8.6355 15.5033 9.5126 10.1448 6.54501 numMergedOcc 0
26 mol 134 unq 7 iso 0 dist 9.60411 6.27009 5.42582 14.0674 5.00817 8.6355 10.5108 6.37586 5.41704 6.49416 numMergedOcc 0
27 mol 134 unq 8 iso 0 dist 9.55556 10.2625 8.79571 12.1043 5.49782 5.42582 11.9294 8.94367 5.41704 6.37586 numMergedOcc 0
28 mol 134 unq 9 iso 0 dist 9.55556 10.2625 8.79571 12.1043 5.49782 5.42582 6.36794 9.86662 6.17103 9.71307 numMergedOcc 0
29 mol 134 unq 10 iso 0 dist 9.55556 10.2625 8.79571 16.0579 8.80819 8.6355 16.3074 11.9139 10.1448 6.54501 numMergedOcc 0
30 mol 134 unq 11 iso 0 dist 9.55556 10.2625 8.79571 16.0579 8.80819 8.6355 11.9294 8.94367 5.41704 6.49416 numMergedOcc 0
31 mol 155 unq 0 iso 0 dist 6.7973 5.10076 7.16254 10.6879 5.71071 9.14392 5.01118 6.23493 6.3845 7.46303 numMergedOcc 0
32 mol 155 unq 1 iso 0 dist 6.7973 5.10076 7.16254 10.6879 5.71071 9.14392 12.5957 10.2463 12.1814 6.43582 numMergedOcc 0
33 mol 155 unq 2 iso 0 dist 6.7973 9.64056 9.86313 10.6879 5.71071 7.51198 5.01118 6.23493 5.86939 7.46303 numMergedOcc 0
34 mol 155 unq 3 iso 0 dist 6.7973 9.64056 9.86313 10.6879 5.71071 7.51198 12.5957 10.2463 6.34186 6.43582 numMergedOcc 0
35 mol 155 unq 4 iso 0 dist 4.44292 4.40049 7.39644 10.6076 10.7616 7.36102 10.4606 10.7829 8.27726 6.43582 numMergedOcc 0
36 mol 234 unq 0 iso 0 dist 7.86368 15.442 7.85175 12.3151 5.88703 6.25105 17.6539 12.9605 10.3337 8.34494 numMergedOcc 0
37 mol 234 unq 1 iso 0 dist 7.86368 15.442 7.85175 12.3151 5.88703 6.25105 12.0816 9.45496 11.216 6.56247 numMergedOcc 0
38 mol 234 unq 2 iso 0 dist 7.86368 15.442 7.85175 12.3151 5.88703 6.25105 6.94762 6.7625 11.4315 9.36357 numMergedOcc 0
39 mol 236 unq 0 iso 0 dist 8.90987 14.3961 7.17676 11.2664 7.28249 5.34718 5.26654 8.03456 11.8759 9.81562 numMergedOcc 0
40 mol 236 unq 1 iso 0 dist 8.90987 14.3961 7.17676 11.2664 7.28249 5.34718 3.82437 6.84306 11.3552 7.68742 numMergedOcc 0
41 mol 236 unq 2 iso 0 dist 8.90987 14.3961 7.17676 11.2664 7.28249 5.34718 13.8124 9.99038 6.04825 6.27581 numMergedOcc 0
42 mol 238 unq 0 iso 0 dist 9.13537 6.16476 5.38637 9.01016 5.42006 6.55759 15.0245 10.0756 10.4664 7.31233 numMergedOcc 0
43 mol 238 unq 1 iso 0 dist 9.66555 8.92175 7.49471 11.6545 5.34096 7.19008 12.2428 6.22714 5.17471 7.31233 numMergedOcc 0
44 mol 238 unq 2 iso 0 dist 8.67205 5.94371 7.49471 11.1363 5.34096 7.19008 8.66185 6.22714 5.17471 7.31233 numMergedOcc 0
45 mol 259 unq 0 iso 0 dist 9.12507 4.09442 8.37865 10.5892 12.5353 7.48005 12.1767 15.9169 11.6195 7.88519 numMergedOcc 0
46 mol 259 unq 1 iso 0 dist 9.12507 4.09442 8.37865 10.5892 12.5353 7.48005 12.8636 18.2309 11.8736 7.84554 numMergedOcc 0
47 mol 259 unq 2 iso 0 dist 9.12507 4.09442 8.37865 10.5892 12.5353 7.48005 5.41945 11.858 5.79468 7.46176 numMergedOcc 0
48 mol 259 unq 3 iso 0 dist 9.12507 4.09442 8.37865 10.5892 12.5353 7.48005 14.4131 20.3294 12.6649 9.18903 numMergedOcc 0
49 mol 272 unq 0 iso 0 dist 9.96394 5.98845 6.73206 13.3211 5.40809 9.09992 15.6097 13.2494 10.841 9.97651 numMergedOcc 0
50 mol 272 unq 1 iso 0 dist 9.96394 5.98845 6.73206 13.3211 5.40809 9.09992 11.5918 8.33638 5.63139 8.46116 numMergedOcc 0
