0 mol 96 unq 0 iso 0 dist 9.25716 7.69448 4.96607 5.82685 9.85392 5.92032 numMergedOcc 0
1 mol 96 unq 1 iso 0 dist 6.29224 5.53423 4.96607 5.3958 9.85392 5.92032 numMergedOcc 0
2 mol 96 unq 2 iso 0 dist 8.14767 5.53423 8.36645 5.3958 11.7176 5.92032 numMergedOcc 0
3 mol 98 unq 0 iso 0 dist 8.6969 6.98059 9.70366 9.83687 15.3566 5.88354 numMergedOcc 0
4 mol 98 unq 1 iso 0 dist 8.6969 6.98059 9.70366 11.0059 16.4982 7.89665 numMergedOcc 0
5 mol 98 unq 2 iso 0 dist 8.6969 6.98059 9.70366 12.2571 13.0945 5.39354 numMergedOcc 0
6 mol 98 unq 3 iso 0 dist 8.6969 6.98059 9.70366 12.0258 13.036 5.74854 numMergedOcc 0
7 mol 98 unq 4 iso 0 dist 8.6969 6.98059 9.70366 12.8848 13.8315 8.76566 numMergedOcc 0
8 mol 98 unq 5 iso 0 dist 8.6969 6.98059 9.70366 12.3945 9.00692 8.8368 numMergedOcc 0
9 mol 98 unq 6 iso 0 dist 9.18318 6.98059 7.63357 9.83687 13.5014 5.88354 numMergedOcc 0
10 mol 98 unq 7 iso 0 dist 9.18318 6.98059 7.63357 11.0059 14.6204 7.89665 numMergedOcc 0
11 mol 98 unq 8 iso 0 dist 9.18318 6.98059 7.63357 12.2571 10.0471 5.39354 numMergedOcc 0
12 mol 98 unq 9 iso 0 dist 9.18318 6.98059 7.63357 12.0258 10.465 5.74854 numMergedOcc 0
13 mol 98 unq 10 iso 0 dist 9.18318 6.98059 7.63357 12.8848 11.3239 8.76566 numMergedOcc 0
14 mol 98 unq 11 iso 0 dist 9.18318 6.98059 7.63357 12.3945 6.26542 8.8368 numMergedOcc 0
15 mol 98 unq 12 iso 0 dist 7.94124 5.63127 9.70366 10.6448 15.3566 5.88354 numMergedOcc 0
16 mol 98 unq 13 iso 0 dist 7.94124 5.63127 9.70366 13.4221 16.4982 7.89665 numMergedOcc 0
17 mol 98 unq 14 iso 0 dist 7.94124 5.63127 9.70366 7.96856 13.0945 5.39354 numMergedOcc 0
18 mol 98 unq 15 iso 0 dist 7.94124 5.63127 9.70366 5.58126 13.036 5.74854 numMergedOcc 0
19 mol 98 unq 16 iso 0 dist 7.94124 5.63127 9.70366 12.7489 13.8315 8.76566 numMergedOcc 0
20 mol 98 unq 17 iso 0 dist 7.94124 5.63127 9.70366 9.77595 9.00692 8.8368 numMergedOcc 0
21 mol 98 unq 18 iso 0 dist 5.92298 5.63127 7.63357 10.6448 13.5014 5.88354 numMergedOcc 0
22 mol 98 unq 19 iso 0 dist 5.92298 5.63127 7.63357 13.4221 14.6204 7.89665 numMergedOcc 0
23 mol 98 unq 20 iso 0 dist 5.92298 5.63127 7.63357 7.96856 10.0471 5.39354 numMergedOcc 0
24 mol 98 unq 21 iso 0 dist 5.92298 5.63127 7.63357 5.58126 10.465 5.74854 numMergedOcc 0
25 mol 98 unq 22 iso 0 dist 5.92298 5.63127 7.63357 12.7489 11.3239 8.76566 numMergedOcc 0
26 mol 98 unq 23 iso 0 dist 5.92298 5.63127 7.63357 9.77595 6.26542 8.8368 numMergedOcc 0
27 mol 119 unq 0 iso 0 dist 8.06422 8.38498 10.4914 6.77381 13.2957 6.98934 numMergedOcc 0
28 mol 119 unq 1 iso 0 dist 5.29346 9.69341 5.53632 7.79117 7.85527 7.99623 numMergedOcc 0
29 mol 119 unq 2 iso 0 dist 9.25484 9.69341 8.57466 7.79117 12.3669 7.99623 numMergedOcc 0
30 mol 154 unq 0 iso 0 dist 9.3164 6.89591 11.3475 10.8466 15.0423 7.72144 numMergedOcc 0
31 mol 162 unq 0 iso 0 dist 5.74837 8.47144 7.00811 6.66205 10.1407 8.00506 numMergedOcc 0
32 mol 171 unq 0 iso 0 dist 4.46397 5.94881 5.07688 7.24557 9.43214 9.11712 numMergedOcc 0
33 mol 194 unq 0 iso 0 dist 7.59687 8.26119 10.735 5.69334 9.68918 6.26839 numMergedOcc 0
34 mol 194 unq 1 iso 0 dist 7.59687 8.26119 10.735 13.2099 16.4654 8.12346 numMergedOcc 0
35 mol 194 unq 2 iso 0 dist 7.59687 8.26119 10.735 16.2258 15.4498 8.83356 numMergedOcc 0
36 mol 194 unq 3 iso 0 dist 7.59687 8.26119 10.735 13.4175 13.4844 8.2654 numMergedOcc 0
37 mol 204 unq 0 iso 0 dist 5.24705 7.00964 6.80235 9.70811 11.513 6.85441 numMergedOcc 0
38 mol 212 unq 0 iso 0 dist 8.79252 5.90507 6.99355 5.19318 13.6854 8.74585 numMergedOcc 0
39 mol 212 unq 1 iso 0 dist 9.65834 8.18732 10.9589 4.84098 12.3918 8.57827 numMergedOcc 0
40 mol 212 unq 2 iso 0 dist 9.65834 8.18732 10.9589 6.68718 10.8077 6.29767 numMergedOcc 0
41 mol 212 unq 3 iso 0 dist 8.09995 5.90507 11.5079 5.19318 10.8077 8.74585 numMergedOcc 0
42 mol 230 unq 0 iso 0 dist 9.50208 7.03084 7.81136 11.624 10.8539 6.41286 numMergedOcc 0
43 mol 239 unq 0 iso 0 dist 4.88851 7.96696 5.71442 4.9585 8.7017 8.67805 numMergedOcc 0
44 mol 239 unq 1 iso 0 dist 7.65486 7.96696 8.88857 4.9585 9.51583 8.67805 numMergedOcc 0
45 mol 285 unq 0 iso 0 dist 6.64026 8.32103 10.2946 9.00041 13.3404 5.31728 numMergedOcc 0
46 mol 294 unq 0 iso 0 dist 9.83069 9.66445 18.042 16.3624 24.0855 9.13907 numMergedOcc 0
